(E)-2-cyano-N-(2-methylphenyl)-3-[5-(2-nitrophenyl)thiophen-2-yl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(2-methylphenyl)-3-[5-(2-nitrophenyl)thiophen-2-yl]prop-2-enamide Openeye Name: (E)-2-cyano-3-[5-(2-nitrophenyl)-2-thienyl]-N-(o-tolyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(2-methylphenyl)-3-[5-(2-nitrophenyl)-2-thiophenyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-(2-methylphenyl)-3-[5-(2-nitrophenyl)thiophen-2-yl]prop-2-enamide Traditional Name: (E)-2-cyano-3-[5-(2-nitrophenyl)-2-thienyl]-N-(o-tolyl)acrylamide Formula: C21H15N3O3S MolecularWeight: 389.4271

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(=CC2=CC=C(S2)C3=CC=CC=C3[N+](=O)[O-])C#N

Isomeric SMILES

CC1=CC=CC=C1NC(=O)/C(=C/C2=CC=C(S2)C3=CC=CC=C3[N+](=O)[O-])/C#N

InChI

InChI=1S/C21H15N3O3S/c1-14-6-2-4-8-18(14)23-21(25)15(13-22)12-16-10-11-20(28-16)17-7-3-5-9-19(17)24(26)27/h2-12H,1H3,(H,23,25)/b15-12+