(Z)-3-[4-(4-chlorophenyl)sulfanyl-3-nitro-phenyl]-2-cyano-N-cyclohexyl-prop-2-enamide

Systemtic Name: (Z)-3-[4-(4-chlorophenyl)sulfanyl-3-nitro-phenyl]-2-cyano-N-cyclohexyl-prop-2-enamide Openeye Name: (Z)-3-[4-(4-chlorophenyl)sulfanyl-3-nitro-phenyl]-2-cyano-N-cyclohexyl-prop-2-enamide CAS Name: (Z)-3-[4-[(4-chlorophenyl)thio]-3-nitrophenyl]-2-cyano-N-cyclohexyl-2-propenamide IUPAC Name: (Z)-3-[4-(4-chlorophenyl)sulfanyl-3-nitrophenyl]-2-cyano-N-cyclohexylprop-2-enamide Traditional Name: (Z)-3-[4-[(4-chlorophenyl)thio]-3-nitro-phenyl]-2-cyano-N-cyclohexyl-acrylamide Formula: C22H20ClN3O3S MolecularWeight: 441.9305

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(=CC2=CC(=C(C=C2)SC3=CC=C(C=C3)Cl)[N+](=O)[O-])C#N

Isomeric SMILES

C1CCC(CC1)NC(=O)/C(=C\C2=CC(=C(C=C2)SC3=CC=C(C=C3)Cl)[N+](=O)[O-])/C#N

InChI

InChI=1S/C22H20ClN3O3S/c23-17-7-9-19(10-8-17)30-21-11-6-15(13-20(21)26(28)29)12-16(14-24)22(27)25-18-4-2-1-3-5-18/h6-13,18H,1-5H2,(H,25,27)/b16-12-