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

Systemtic Name: [2-(7-methyl-1H-indazol-5-yl)-1-quinolin-2-yl-ethyl] 4-(2-oxidanylidene-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxylate Openeye Name: [2-(7-methyl-1H-indazol-5-yl)-1-(2-quinolyl)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 [2-(7-methyl-1H-indazol-5-yl)-1-(2-quinolinyl)ethyl] ester IUPAC Name: [2-(7-methyl-1H-indazol-5-yl)-1-quinolin-2-ylethyl] 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 [2-(7-methyl-1H-indazol-5-yl)-1-(2-quinolyl)ethyl] ester Formula: C33H32N6O3 MolecularWeight: 560.64558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)CC(C3=NC4=CC=CC=C4C=C3)OC(=O)N5CCC(CC5)N6CC7=CC=CC=C7NC6=O)C=NN2

Isomeric SMILES

CC1=C2C(=CC(=C1)CC(C3=NC4=CC=CC=C4C=C3)OC(=O)N5CCC(CC5)N6CC7=CC=CC=C7NC6=O)C=NN2

InChI

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