5-chloranyl-3-methyl-1-(2-methylpropyl)-N-(5-piperidin-1-ylisoquinolin-8-yl)pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-1-(2-methylpropyl)-N-(5-piperidin-1-ylisoquinolin-8-yl)pyrazole-4-carboxamide Openeye Name: 5-chloro-1-isobutyl-3-methyl-N-[5-(1-piperidyl)-8-isoquinolyl]pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-1-(2-methylpropyl)-N-[5-(1-piperidinyl)-8-isoquinolinyl]-4-pyrazolecarboxamide IUPAC Name: 5-chloro-3-methyl-1-(2-methylpropyl)-N-(5-piperidin-1-ylisoquinolin-8-yl)pyrazole-4-carboxamide Traditional Name: 5-chloro-1-isobutyl-3-methyl-N-(5-piperidino-8-isoquinolyl)pyrazole-4-carboxamide Formula: C23H28ClN5O MolecularWeight: 425.95432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4)Cl)CC(C)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4)Cl)CC(C)C

InChI

InChI=1S/C23H28ClN5O/c1-15(2)14-29-22(24)21(16(3)27-29)23(30)26-19-7-8-20(28-11-5-4-6-12-28)17-9-10-25-13-18(17)19/h7-10,13,15H,4-6,11-12,14H2,1-3H3,(H,26,30)