1-methyl-5-[(phenylmethyl)amino]-N-(pyridin-4-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide

Systemtic Name: 1-methyl-5-[(phenylmethyl)amino]-N-(pyridin-4-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Openeye Name: 5-(benzylamino)-1-methyl-N-(4-pyridylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide CAS Name: 1-methyl-5-[(phenylmethyl)amino]-N-(pyridin-4-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide IUPAC Name: 5-(benzylamino)-1-methyl-N-(pyridin-4-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Traditional Name: 5-(benzylamino)-1-methyl-N-(4-pyridylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Formula: C22H25N5O MolecularWeight: 375.4668

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(CC2)NCC3=CC=CC=C3)C(=N1)C(=O)NCC4=CC=NC=C4

Isomeric SMILES

CN1C2=C(CC(CC2)NCC3=CC=CC=C3)C(=N1)C(=O)NCC4=CC=NC=C4

InChI

InChI=1S/C22H25N5O/c1-27-20-8-7-18(24-14-16-5-3-2-4-6-16)13-19(20)21(26-27)22(28)25-15-17-9-11-23-12-10-17/h2-6,9-12,18,24H,7-8,13-15H2,1H3,(H,25,28)