AC1NCN04 structure

AC1NCN04

2-[4-chloro-3-(trifluoromethyl)phenyl]imino-3-methyl-N-(3-methylphenyl)-4-oxo-1,3-thiazinane-6-carboxamide

Also Known As: AG-205/15155032|SR-01000534796-1|2-{[4-chloro-3-(trifluoromethyl)phenyl]imino}-3-methyl-N-(3-methylphenyl)-4-oxo-1,3-thiazinane-6-carboxamide|A2635/0112207|2-[4-chloro-3-(trifluoromethyl)phenyl]imino-3-methyl-N-(3-methylphenyl)-4-oxo-1,3-thiazinane-6-carboxamide|(2Z)-2-{[4-chloro-3-(trifluoromethyl)phenyl]imino}-3-methyl-N-(3-methylphenyl)-4-oxo-1,3-thiazinane-6-carboxamide|(2E)-2-{[4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL]IMINO}-3-METHYL-N-(3-METHYLPHENYL)-4-OXO-1,3-THIAZINANE-6-CARBOXAMIDE|(E)-2-((4-chloro-3-(trifluoromethyl)phenyl)imino)-3-methyl-4-oxo-N-(m-tolyl)-1,3-thiazinane-6-carboxamide

CAS: 442872-91-5
Molecular Formula C20H17ClF3N3O2S
Molecular Weight 455.0682 g/mol
LogP 5.25732
Topological Polar Surface Area 61.77 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 3
Exact Mass 455.0682
Monoisotopic Mass 455.0682
Heavy Atoms 30
Complexity 1026.5966

Chemical Identifiers

CAS Number 442872-91-5
SMILES CC1=CC(=CC=C1)NC(=O)C2CC(=O)N(C(=NC3=CC(=C(C=C3)Cl)C(F)(F)F)S2)C

Product Overview

AC1NCN04 (CAS 442872-91-5), with molecular formula C20H17ClF3N3O2S and molecular weight 455.0682 g/mol. IUPAC: 2-[4-chloro-3-(trifluoromethyl)phenyl]imino-3-methyl-N-(3-methylphenyl)-4-oxo-1,3-thiazinane-6-carboxamide.

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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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