3-(4-chlorophenyl)-N-[[4-(ethanoylcarbamothioylamino)phenyl]carbamothioyl]prop-2-enamide

Systemtic Name: 3-(4-chlorophenyl)-N-[[4-(ethanoylcarbamothioylamino)phenyl]carbamothioyl]prop-2-enamide Openeye Name: N-[[4-(acetylcarbamothioylamino)phenyl]carbamothioyl]-3-(4-chlorophenyl)prop-2-enamide CAS Name: N-[[4-[[acetamido(sulfanylidene)methyl]amino]anilino]-sulfanylidenemethyl]-3-(4-chlorophenyl)-2-propenamide IUPAC Name: N-[[4-(acetylcarbamothioylamino)phenyl]carbamothioyl]-3-(4-chlorophenyl)prop-2-enamide Traditional Name: N-[[4-(acetylthiocarbamoylamino)phenyl]thiocarbamoyl]-3-(4-chlorophenyl)acrylamide Formula: C19H17ClN4O2S2 MolecularWeight: 432.94688

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=S)NC1=CC=C(C=C1)NC(=S)NC(=O)C=CC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(=O)NC(=S)NC1=CC=C(C=C1)NC(=S)NC(=O)C=CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H17ClN4O2S2/c1-12(25)21-18(27)22-15-7-9-16(10-8-15)23-19(28)24-17(26)11-4-13-2-5-14(20)6-3-13/h2-11H,1H3,(H2,21,22,25,27)(H2,23,24,26,28)