AC1LXKO7 structure

AC1LXKO7

diethyl 5-(benzoylcarbamothioylamino)-3-methylthiophene-2,4-dicarboxylate

Also Known As: 2,4-DIETHYL 3-METHYL-5-{[(PHENYLFORMAMIDO)METHANETHIOYL]AMINO}THIOPHENE-2,4-DICARBOXYLATE|BAS 00463213|diethyl 5-(3-benzoylthioureido)-3-methylthiophene-2,4-dicarboxylate|F0360-0001|5-(3-Benzoyl-thioureido)-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester|diethyl 5-(benzoylcarbamothioylamino)-3-methylthiophene-2,4-dicarboxylate|diethyl 5-(3-benzoylthioureido)-3-methyl-2,4-thiophenedicarboxylate|diethyl 5-(benzoylcarbamothioylamino)-3-methyl-thiophene-2,4-dicarboxylate|diethyl 3-methyl-5-{[(phenylcarbonyl)carbamothioyl]amino}thiophene-2,4-dicarboxylate|ethyl 5-(ethoxycarbonyl)-4-methyl-2-{[(phenylcarbonylamino)thioxomethyl]amino} thiophene-3-carboxylate|N/A

CAS: 117516-89-9
Molecular Formula C19H20N2O5S2
Molecular Weight 420.08136 g/mol
LogP 3.53672
Topological Polar Surface Area 93.73 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 7
Rotatable Bonds 6
Exact Mass 420.08136
Monoisotopic Mass 420.08136
Heavy Atoms 28
Complexity 893.229

Chemical Identifiers

CAS Number 117516-89-9
SMILES CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)NC(=O)C2=CC=CC=C2

Product Overview

AC1LXKO7 (CAS 117516-89-9), with molecular formula C19H20N2O5S2 and molecular weight 420.08136 g/mol. IUPAC: diethyl 5-(benzoylcarbamothioylamino)-3-methylthiophene-2,4-dicarboxylate.

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