Thiophamine structure

Thiophamine

methyl N-[(2-aminophenyl)carbamothioyl]carbamate

Also Known As: Thiophamine|Methyl [(2-aminophenyl)carbamothioyl]carbamate|2- aniline|2-(3-methoxycarbonylthioureido)aniline|NF 48|2-(3-Carbomethoxythioureido)aniline|NF-48|Methyl 4-(o-aminophenyl)-3-thioallophanate|methyl N-[(2-aminophenyl)carbamothioyl]carbamate|2-(3-(Methoxycarbonyl)thioureido)aniline|N-(3-Methoxycarbonyl-2-thioureido)aniline|2-Amino((methoxycarbonyl)thioureido)benzene|DS-9976|KS-0000008D|2-(3-methoxycarbonyl-thioureido)-aniline|Methyl 4-(o-aminophenyl)-3thioallophanate|1-methoxycarbonyl-3-(2-aminophenyl)thiourea|Methyl[(2-aminophenyl)carbamothioyl]carbamate|1-methoxycarbonyl-3-(2-aminophenyl)-thiourea|methyl N ?[aminophenyl)carbamothioyl)carbamate|1-(2-aminophenyl)-3-methoxycarbonyl-2-thiourea|Carbamic acid, [[(2-aminophenyl)amino]thioxomethyl]-, methyl ester|methyl aminoN-(2-aminophenyl)methanethiocarbamate|methyl N ?[aminophenyl)carbamothioyl)carbamate|ALLOPHANIC ACID, 4-(o-AMINOPHENYL)-3-THIO-, METHYL ESTER|Carbamic acid, (((2-aminophenyl)amino)thioxomethyl)-, methyl ester

CAS: 27079-29-4
Molecular Formula C9H11N3O2S
Molecular Weight 225.0572 g/mol
LogP 1.3216
Topological Polar Surface Area 76.38 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 4
Rotatable Bonds 1
Exact Mass 225.0572
Monoisotopic Mass 225.0572
Heavy Atoms 15
Complexity 381.37512

Chemical Identifiers

CAS Number 27079-29-4
SMILES COC(=O)NC(=S)NC1=CC=CC=C1N

Product Overview

Thiophamine (CAS 27079-29-4), with molecular formula C9H11N3O2S and molecular weight 225.0572 g/mol. IUPAC: methyl N-[(2-aminophenyl)carbamothioyl]carbamate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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