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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15N3O3S/c22-13-16(21(25)23-14-15-6-2-1-3-7-15)12-17-10-11-20(28-17)18-8-4-5-9-19(18)24(26)27/h1-12H,14H2,(H,23,25)/b16-12+