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

Systemtic Name: (E)-2-cyano-N-(3-methoxyphenyl)-3-[5-(3-nitrophenyl)thiophen-2-yl]prop-2-enamide Openeye Name: (E)-2-cyano-N-(3-methoxyphenyl)-3-[5-(3-nitrophenyl)-2-thienyl]prop-2-enamide CAS Name: (E)-2-cyano-N-(3-methoxyphenyl)-3-[5-(3-nitrophenyl)-2-thiophenyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-(3-methoxyphenyl)-3-[5-(3-nitrophenyl)thiophen-2-yl]prop-2-enamide Traditional Name: (E)-2-cyano-N-(3-methoxyphenyl)-3-[5-(3-nitrophenyl)-2-thienyl]acrylamide Formula: C21H15N3O4S MolecularWeight: 405.4265

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C(=CC2=CC=C(S2)C3=CC(=CC=C3)[N+](=O)[O-])C#N

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)/C(=C/C2=CC=C(S2)C3=CC(=CC=C3)[N+](=O)[O-])/C#N

InChI

InChI=1S/C21H15N3O4S/c1-28-18-7-3-5-16(12-18)23-21(25)15(13-22)11-19-8-9-20(29-19)14-4-2-6-17(10-14)24(26)27/h2-12H,1H3,(H,23,25)/b15-11+