tert-butyl 6-[phenylcarbonyl-[(1-pyridin-4-ylpiperidin-4-yl)carbonylamino]amino]indazole-1-carboxylate

Systemtic Name: tert-butyl 6-[phenylcarbonyl-[(1-pyridin-4-ylpiperidin-4-yl)carbonylamino]amino]indazole-1-carboxylate Openeye Name: tert-butyl 6-[benzoyl-[[1-(4-pyridyl)piperidine-4-carbonyl]amino]amino]indazole-1-carboxylate CAS Name: 6-[benzoyl-[[oxo-(1-pyridin-4-yl-4-piperidinyl)methyl]amino]amino]-1-indazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-[benzoyl-[(1-pyridin-4-ylpiperidine-4-carbonyl)amino]amino]indazole-1-carboxylate Traditional Name: 6-[benzoyl-[[1-(4-pyridyl)isonipecotoyl]amino]amino]indazole-1-carboxylic acid tert-butyl ester Formula: C30H32N6O4 MolecularWeight: 540.61288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=C(C=CC(=C2)N(C(=O)C3=CC=CC=C3)NC(=O)C4CCN(CC4)C5=CC=NC=C5)C=N1

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=C(C=CC(=C2)N(C(=O)C3=CC=CC=C3)NC(=O)C4CCN(CC4)C5=CC=NC=C5)C=N1

InChI

InChI=1S/C30H32N6O4/c1-30(2,3)40-29(39)36-26-19-25(10-9-23(26)20-32-36)35(28(38)22-7-5-4-6-8-22)33-27(37)21-13-17-34(18-14-21)24-11-15-31-16-12-24/h4-12,15-16,19-21H,13-14,17-18H2,1-3H3,(H,33,37)