2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-oxidanylidene-N-(5-piperidin-1-ylisoquinolin-8-yl)ethanamide

Systemtic Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-oxidanylidene-N-(5-piperidin-1-ylisoquinolin-8-yl)ethanamide Openeye Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-oxo-N-[5-(1-piperidyl)-8-isoquinolyl]acetamide CAS Name: 2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-oxo-N-[5-(1-piperidinyl)-8-isoquinolinyl]acetamide IUPAC Name: 2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-oxo-N-(5-piperidin-1-ylisoquinolin-8-yl)acetamide Traditional Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-keto-N-(5-piperidino-8-isoquinolyl)acetamide Formula: C27H27N5O2 MolecularWeight: 453.53558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)C(=O)NC3=C4C=NC=CC4=C(C=C3)N5CCCCC5

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)C(=O)NC3=C4C=NC=CC4=C(C=C3)N5CCCCC5

InChI

InChI=1S/C27H27N5O2/c1-18-25(19(2)32(30-18)20-9-5-3-6-10-20)26(33)27(34)29-23-11-12-24(31-15-7-4-8-16-31)21-13-14-28-17-22(21)23/h3,5-6,9-14,17H,4,7-8,15-16H2,1-2H3,(H,29,34)