5-chloranyl-1-[(4-fluorophenyl)methyl]-3-methyl-N-(5-piperidin-1-ylisoquinolin-8-yl)pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-1-[(4-fluorophenyl)methyl]-3-methyl-N-(5-piperidin-1-ylisoquinolin-8-yl)pyrazole-4-carboxamide Openeye Name: 5-chloro-1-[(4-fluorophenyl)methyl]-3-methyl-N-[5-(1-piperidyl)-8-isoquinolyl]pyrazole-4-carboxamide CAS Name: 5-chloro-1-[(4-fluorophenyl)methyl]-3-methyl-N-[5-(1-piperidinyl)-8-isoquinolinyl]-4-pyrazolecarboxamide IUPAC Name: 5-chloro-1-[(4-fluorophenyl)methyl]-3-methyl-N-(5-piperidin-1-ylisoquinolin-8-yl)pyrazole-4-carboxamide Traditional Name: 5-chloro-1-(4-fluorobenzyl)-3-methyl-N-(5-piperidino-8-isoquinolyl)pyrazole-4-carboxamide Formula: C26H25ClFN5O MolecularWeight: 477.961003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4)Cl)CC5=CC=C(C=C5)F

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4)Cl)CC5=CC=C(C=C5)F

InChI

InChI=1S/C26H25ClFN5O/c1-17-24(25(27)33(31-17)16-18-5-7-19(28)8-6-18)26(34)30-22-9-10-23(32-13-3-2-4-14-32)20-11-12-29-15-21(20)22/h5-12,15H,2-4,13-14,16H2,1H3,(H,30,34)