(E)-N-[[4-methyl-3-(propanoylamino)phenyl]carbamothioyl]-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-[[4-methyl-3-(propanoylamino)phenyl]carbamothioyl]-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-[[4-methyl-3-(propanoylamino)phenyl]carbamothioyl]-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-[[4-methyl-3-(1-oxopropylamino)anilino]-sulfanylidenemethyl]-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-[[4-methyl-3-(propanoylamino)phenyl]carbamothioyl]-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-[(4-methyl-3-propionamido-phenyl)thiocarbamoyl]-3-(2-thienyl)acrylamide Formula: C18H19N3O2S2 MolecularWeight: 373.49236

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=CC(=C1)NC(=S)NC(=O)C=CC2=CC=CS2)C

Isomeric SMILES

CCC(=O)NC1=C(C=CC(=C1)NC(=S)NC(=O)/C=C/C2=CC=CS2)C

InChI

InChI=1S/C18H19N3O2S2/c1-3-16(22)20-15-11-13(7-6-12(15)2)19-18(24)21-17(23)9-8-14-5-4-10-25-14/h4-11H,3H2,1-2H3,(H,20,22)(H2,19,21,23,24)/b9-8+