2-cyano-N-(4-methoxyphenyl)-3,3-bis(phenacylsulfanyl)prop-2-enamide

Systemtic Name: 2-cyano-N-(4-methoxyphenyl)-3,3-bis(phenacylsulfanyl)prop-2-enamide Openeye Name: 2-cyano-N-(4-methoxyphenyl)-3,3-bis(phenacylsulfanyl)prop-2-enamide CAS Name: 2-cyano-N-(4-methoxyphenyl)-3,3-bis(phenacylthio)-2-propenamide IUPAC Name: 2-cyano-N-(4-methoxyphenyl)-3,3-bis(phenacylsulfanyl)prop-2-enamide Traditional Name: 2-cyano-N-(4-methoxyphenyl)-3,3-bis(phenacylthio)acrylamide Formula: C27H22N2O4S2 MolecularWeight: 502.60458

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C(=C(SCC(=O)C2=CC=CC=C2)SCC(=O)C3=CC=CC=C3)C#N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C(=C(SCC(=O)C2=CC=CC=C2)SCC(=O)C3=CC=CC=C3)C#N

InChI

InChI=1S/C27H22N2O4S2/c1-33-22-14-12-21(13-15-22)29-26(32)23(16-28)27(34-17-24(30)19-8-4-2-5-9-19)35-18-25(31)20-10-6-3-7-11-20/h2-15H,17-18H2,1H3,(H,29,32)