N-cycloheptyl-1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-cycloheptyl-1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-cycloheptyl-1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)piperidine-4-carboxamide CAS Name: N-cycloheptyl-1-[[3-methyl-1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-cycloheptyl-1-(3-methyl-1-phenyl-5-pyrrol-1-ylpyrazole-4-carbonyl)piperidine-4-carboxamide Traditional Name: N-cycloheptyl-1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)isonipecotamide Formula: C28H35N5O2 MolecularWeight: 473.6098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)N2CCC(CC2)C(=O)NC3CCCCCC3)N4C=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1C(=O)N2CCC(CC2)C(=O)NC3CCCCCC3)N4C=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H35N5O2/c1-21-25(27(31-17-9-10-18-31)33(30-21)24-13-7-4-8-14-24)28(35)32-19-15-22(16-20-32)26(34)29-23-11-5-2-3-6-12-23/h4,7-10,13-14,17-18,22-23H,2-3,5-6,11-12,15-16,19-20H2,1H3,(H,29,34)