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

Systemtic Name: N-(4-chlorophenyl)-2-cyano-3,3-bis(phenacylsulfanyl)prop-2-enamide Openeye Name: N-(4-chlorophenyl)-2-cyano-3,3-bis(phenacylsulfanyl)prop-2-enamide CAS Name: N-(4-chlorophenyl)-2-cyano-3,3-bis(phenacylthio)-2-propenamide IUPAC Name: N-(4-chlorophenyl)-2-cyano-3,3-bis(phenacylsulfanyl)prop-2-enamide Traditional Name: N-(4-chlorophenyl)-2-cyano-3,3-bis(phenacylthio)acrylamide Formula: C26H19ClN2O3S2 MolecularWeight: 507.02366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC(=C(C#N)C(=O)NC2=CC=C(C=C2)Cl)SCC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC(=C(C#N)C(=O)NC2=CC=C(C=C2)Cl)SCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H19ClN2O3S2/c27-20-11-13-21(14-12-20)29-25(32)22(15-28)26(33-16-23(30)18-7-3-1-4-8-18)34-17-24(31)19-9-5-2-6-10-19/h1-14H,16-17H2,(H,29,32)