N,1-dimethyl-N-(phenylmethyl)-5-(pyridin-4-ylmethylamino)-4,5,6,7-tetrahydroindazole-3-carboxamide

Systemtic Name: N,1-dimethyl-N-(phenylmethyl)-5-(pyridin-4-ylmethylamino)-4,5,6,7-tetrahydroindazole-3-carboxamide Openeye Name: N-benzyl-N,1-dimethyl-5-(4-pyridylmethylamino)-4,5,6,7-tetrahydroindazole-3-carboxamide CAS Name: N,1-dimethyl-N-(phenylmethyl)-5-(pyridin-4-ylmethylamino)-4,5,6,7-tetrahydroindazole-3-carboxamide IUPAC Name: N-benzyl-N,1-dimethyl-5-(pyridin-4-ylmethylamino)-4,5,6,7-tetrahydroindazole-3-carboxamide Traditional Name: N-benzyl-N,1-dimethyl-5-(4-pyridylmethylamino)-4,5,6,7-tetrahydroindazole-3-carboxamide Formula: C23H27N5O MolecularWeight: 389.49338

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(CC2)NCC3=CC=NC=C3)C(=N1)C(=O)N(C)CC4=CC=CC=C4

Isomeric SMILES

CN1C2=C(CC(CC2)NCC3=CC=NC=C3)C(=N1)C(=O)N(C)CC4=CC=CC=C4

InChI

InChI=1S/C23H27N5O/c1-27(16-18-6-4-3-5-7-18)23(29)22-20-14-19(8-9-21(20)28(2)26-22)25-15-17-10-12-24-13-11-17/h3-7,10-13,19,25H,8-9,14-16H2,1-2H3