methyl N-[[5-(phenylcarbonyl)-2-(propanoylamino)phenyl]carbamothioyl]carbamate

Systemtic Name: methyl N-[[5-(phenylcarbonyl)-2-(propanoylamino)phenyl]carbamothioyl]carbamate Openeye Name: methyl N-[[5-benzoyl-2-(propanoylamino)phenyl]carbamothioyl]carbamate CAS Name: N-[[5-benzoyl-2-(1-oxopropylamino)anilino]-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[[5-benzoyl-2-(propanoylamino)phenyl]carbamothioyl]carbamate Traditional Name: N-[(5-benzoyl-2-propionamido-phenyl)thiocarbamoyl]carbamic acid methyl ester Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)NC(=S)NC(=O)OC

Isomeric SMILES

CCC(=O)NC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)NC(=S)NC(=O)OC

InChI

InChI=1S/C19H19N3O4S/c1-3-16(23)20-14-10-9-13(17(24)12-7-5-4-6-8-12)11-15(14)21-18(27)22-19(25)26-2/h4-11H,3H2,1-2H3,(H,20,23)(H2,21,22,25,27)