(E)-2-cyano-3-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide Openeye Name: (E)-2-cyano-3-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide CAS Name: (E)-2-cyano-3-(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)-N-[(1S,2S)-2-methylcyclohexyl]-2-propenamide IUPAC Name: (E)-2-cyano-3-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide Traditional Name: (E)-2-cyano-3-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)-N-[(1S,2S)-2-methylcyclohexyl]acrylamide Formula: C20H29N3O MolecularWeight: 327.46376

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C(=CC2=C(N(C(=C2)C)C(C)C)C)C#N

Isomeric SMILES

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

InChI

InChI=1S/C20H29N3O/c1-13(2)23-15(4)10-17(16(23)5)11-18(12-21)20(24)22-19-9-7-6-8-14(19)3/h10-11,13-14,19H,6-9H2,1-5H3,(H,22,24)/b18-11+/t14-,19-/m0/s1