3,4-dihydro-1H-isoquinolin-2-yl-[1-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonylpiperidin-3-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonylpiperidin-3-yl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)-3-piperidyl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-[oxo-[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]methyl]-3-piperidinyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(1-phenyl-5-pyrrol-1-ylpyrazole-4-carbonyl)piperidin-3-yl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)-3-piperidyl]methanone Formula: C29H29N5O2 MolecularWeight: 479.57286

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4)C(=O)N5CCC6=CC=CC=C6C5

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4)C(=O)N5CCC6=CC=CC=C6C5

InChI

InChI=1S/C29H29N5O2/c35-28(33-18-14-22-9-4-5-10-23(22)20-33)24-11-8-17-32(21-24)29(36)26-19-30-34(25-12-2-1-3-13-25)27(26)31-15-6-7-16-31/h1-7,9-10,12-13,15-16,19,24H,8,11,14,17-18,20-21H2