(Z)-2-(4-chlorophenyl)sulfonyl-3-octylsulfanyl-3-phenylazanyl-prop-2-enenitrile

Systemtic Name: (Z)-2-(4-chlorophenyl)sulfonyl-3-octylsulfanyl-3-phenylazanyl-prop-2-enenitrile Openeye Name: (Z)-3-anilino-2-(4-chlorophenyl)sulfonyl-3-octylsulfanyl-prop-2-enenitrile CAS Name: (Z)-3-anilino-2-(4-chlorophenyl)sulfonyl-3-(octylthio)-2-propenenitrile IUPAC Name: (Z)-3-anilino-2-(4-chlorophenyl)sulfonyl-3-octylsulfanylprop-2-enenitrile Traditional Name: (Z)-3-anilino-2-(4-chlorophenyl)sulfonyl-3-(octylthio)acrylonitrile Formula: C23H27ClN2O2S2 MolecularWeight: 463.05568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC(=C(C#N)S(=O)(=O)C1=CC=C(C=C1)Cl)NC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCS/C(=C(/C#N)\S(=O)(=O)C1=CC=C(C=C1)Cl)/NC2=CC=CC=C2

InChI

InChI=1S/C23H27ClN2O2S2/c1-2-3-4-5-6-10-17-29-23(26-20-11-8-7-9-12-20)22(18-25)30(27,28)21-15-13-19(24)14-16-21/h7-9,11-16,26H,2-6,10,17H2,1H3/b23-22-