(E)-3-(4-chloranyl-3-nitro-phenyl)-N-[2-(4-methylphenyl)sulfanylethyl]prop-2-enamide

Systemtic Name: (E)-3-(4-chloranyl-3-nitro-phenyl)-N-[2-(4-methylphenyl)sulfanylethyl]prop-2-enamide Openeye Name: (E)-3-(4-chloro-3-nitro-phenyl)-N-[2-(p-tolylsulfanyl)ethyl]prop-2-enamide CAS Name: (E)-3-(4-chloro-3-nitrophenyl)-N-[2-[(4-methylphenyl)thio]ethyl]-2-propenamide IUPAC Name: (E)-3-(4-chloro-3-nitrophenyl)-N-[2-(4-methylphenyl)sulfanylethyl]prop-2-enamide Traditional Name: (E)-3-(4-chloro-3-nitro-phenyl)-N-[2-(p-tolylthio)ethyl]acrylamide Formula: C18H17ClN2O3S MolecularWeight: 376.85718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)/C=C/C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN2O3S/c1-13-2-6-15(7-3-13)25-11-10-20-18(22)9-5-14-4-8-16(19)17(12-14)21(23)24/h2-9,12H,10-11H2,1H3,(H,20,22)/b9-5+