[1-isoquinolin-3-yl-2-(7-methyl-1H-indazol-5-yl)ethyl] 4-(2-oxidanylidene-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxylate

Systemtic Name: [1-isoquinolin-3-yl-2-(7-methyl-1H-indazol-5-yl)ethyl] 4-(2-oxidanylidene-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxylate Openeye Name: [1-(3-isoquinolyl)-2-(7-methyl-1H-indazol-5-yl)ethyl] 4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxylate CAS Name: 4-(2-oxo-1,4-dihydroquinazolin-3-yl)-1-piperidinecarboxylic acid [1-(3-isoquinolinyl)-2-(7-methyl-1H-indazol-5-yl)ethyl] ester IUPAC Name: [1-isoquinolin-3-yl-2-(7-methyl-1H-indazol-5-yl)ethyl] 4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxylate Traditional Name: 4-(2-keto-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxylic acid [1-(3-isoquinolyl)-2-(7-methyl-1H-indazol-5-yl)ethyl] ester Formula: C33H32N6O3 MolecularWeight: 560.64558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)CC(C3=CC4=CC=CC=C4C=N3)OC(=O)N5CCC(CC5)N6CC7=CC=CC=C7NC6=O)C=NN2

Isomeric SMILES

CC1=C2C(=CC(=C1)CC(C3=CC4=CC=CC=C4C=N3)OC(=O)N5CCC(CC5)N6CC7=CC=CC=C7NC6=O)C=NN2

InChI

InChI=1S/C33H32N6O3/c1-21-14-22(15-26-19-35-37-31(21)26)16-30(29-17-23-6-2-3-7-24(23)18-34-29)42-33(41)38-12-10-27(11-13-38)39-20-25-8-4-5-9-28(25)36-32(39)40/h2-9,14-15,17-19,27,30H,10-13,16,20H2,1H3,(H,35,37)(H,36,40)