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

Systemtic Name: (Z)-3-[4-(4-chlorophenyl)sulfanyl-3-nitro-phenyl]-2-cyano-N-methyl-prop-2-enamide Openeye Name: (Z)-3-[4-(4-chlorophenyl)sulfanyl-3-nitro-phenyl]-2-cyano-N-methyl-prop-2-enamide CAS Name: (Z)-3-[4-[(4-chlorophenyl)thio]-3-nitrophenyl]-2-cyano-N-methyl-2-propenamide IUPAC Name: (Z)-3-[4-(4-chlorophenyl)sulfanyl-3-nitrophenyl]-2-cyano-N-methylprop-2-enamide Traditional Name: (Z)-3-[4-[(4-chlorophenyl)thio]-3-nitro-phenyl]-2-cyano-N-methyl-acrylamide Formula: C17H12ClN3O3S MolecularWeight: 373.81348

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C(=CC1=CC(=C(C=C1)SC2=CC=C(C=C2)Cl)[N+](=O)[O-])C#N

Isomeric SMILES

CNC(=O)/C(=C\C1=CC(=C(C=C1)SC2=CC=C(C=C2)Cl)[N+](=O)[O-])/C#N

InChI

InChI=1S/C17H12ClN3O3S/c1-20-17(22)12(10-19)8-11-2-7-16(15(9-11)21(23)24)25-14-5-3-13(18)4-6-14/h2-9H,1H3,(H,20,22)/b12-8-