(E)-2-cyano-N-(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enamide CAS Name: (E)-2-cyano-N-(3-cyano-4-ethyl-5-methyl-2-thiophenyl)-3-(1,3-diphenyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-3-(1,3-diphenylpyrazol-4-yl)acrylamide Formula: C27H21N5OS MolecularWeight: 463.55354

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C#N)NC(=O)C(=CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C#N)C

Isomeric SMILES

CCC1=C(SC(=C1C#N)NC(=O)/C(=C/C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)/C#N)C

InChI

InChI=1S/C27H21N5OS/c1-3-23-18(2)34-27(24(23)16-29)30-26(33)20(15-28)14-21-17-32(22-12-8-5-9-13-22)31-25(21)19-10-6-4-7-11-19/h4-14,17H,3H2,1-2H3,(H,30,33)/b20-14+