(E)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]-3-(1-phenylpyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]-3-(1-phenylpyrazol-4-yl)prop-2-enamide Openeye Name: (E)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]-3-(1-phenylpyrazol-4-yl)prop-2-enamide CAS Name: (E)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]-3-(1-phenyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]-3-(1-phenylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]-3-(1-phenylpyrazol-4-yl)acrylamide Formula: C20H22N4O MolecularWeight: 334.41488

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C(=CC2=CN(N=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)/C(=C/C2=CN(N=C2)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C20H22N4O/c1-15-7-5-6-10-19(15)23-20(25)17(12-21)11-16-13-22-24(14-16)18-8-3-2-4-9-18/h2-4,8-9,11,13-15,19H,5-7,10H2,1H3,(H,23,25)/b17-11+/t15-,19-/m0/s1