(E)-3-(2,4-dimethoxyphenyl)-N-[3-oxidanylidene-1-phenyl-4-(thiophen-3-ylmethylsulfanyl)butan-2-yl]prop-2-enamide

Systemtic Name: (E)-3-(2,4-dimethoxyphenyl)-N-[3-oxidanylidene-1-phenyl-4-(thiophen-3-ylmethylsulfanyl)butan-2-yl]prop-2-enamide Openeye Name: (E)-N-[1-benzyl-2-oxo-3-(3-thienylmethylsulfanyl)propyl]-3-(2,4-dimethoxyphenyl)prop-2-enamide CAS Name: (E)-3-(2,4-dimethoxyphenyl)-N-[3-oxo-1-phenyl-4-(3-thiophenylmethylthio)butan-2-yl]-2-propenamide IUPAC Name: (E)-3-(2,4-dimethoxyphenyl)-N-[3-oxo-1-phenyl-4-(thiophen-3-ylmethylsulfanyl)butan-2-yl]prop-2-enamide Traditional Name: (E)-N-[1-benzyl-2-keto-3-(3-thenylthio)propyl]-3-(2,4-dimethoxyphenyl)acrylamide Formula: C26H27NO4S2 MolecularWeight: 481.62688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C=CC(=O)NC(CC2=CC=CC=C2)C(=O)CSCC3=CSC=C3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)/C=C/C(=O)NC(CC2=CC=CC=C2)C(=O)CSCC3=CSC=C3)OC

InChI

InChI=1S/C26H27NO4S2/c1-30-22-10-8-21(25(15-22)31-2)9-11-26(29)27-23(14-19-6-4-3-5-7-19)24(28)18-33-17-20-12-13-32-16-20/h3-13,15-16,23H,14,17-18H2,1-2H3,(H,27,29)/b11-9+