2-[(7-methyl-1H-indazol-5-yl)methyl]-4-[4-(2-oxidanylidene-1,4-dihydroquinazolin-3-yl)piperidin-1-yl]-1-piperidin-1-yl-butane-1,4-dione

Systemtic Name: 2-[(7-methyl-1H-indazol-5-yl)methyl]-4-[4-(2-oxidanylidene-1,4-dihydroquinazolin-3-yl)piperidin-1-yl]-1-piperidin-1-yl-butane-1,4-dione Openeye Name: 2-[(7-methyl-1H-indazol-5-yl)methyl]-4-[4-(2-oxo-1,4-dihydroquinazolin-3-yl)-1-piperidyl]-1-(1-piperidyl)butane-1,4-dione CAS Name: 2-[(7-methyl-1H-indazol-5-yl)methyl]-4-[4-(2-oxo-1,4-dihydroquinazolin-3-yl)-1-piperidinyl]-1-(1-piperidinyl)butane-1,4-dione IUPAC Name: 2-[(7-methyl-1H-indazol-5-yl)methyl]-4-[4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidin-1-yl]-1-piperidin-1-ylbutane-1,4-dione Traditional Name: 4-[4-(2-keto-1,4-dihydroquinazolin-3-yl)piperidino]-2-[(7-methyl-1H-indazol-5-yl)methyl]-1-piperidino-butane-1,4-dione Formula: C31H38N6O3 MolecularWeight: 542.67182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)CC(CC(=O)N3CCC(CC3)N4CC5=CC=CC=C5NC4=O)C(=O)N6CCCCC6)C=NN2

Isomeric SMILES

CC1=C2C(=CC(=C1)CC(CC(=O)N3CCC(CC3)N4CC5=CC=CC=C5NC4=O)C(=O)N6CCCCC6)C=NN2

InChI

InChI=1S/C31H38N6O3/c1-21-15-22(17-25-19-32-34-29(21)25)16-24(30(39)36-11-5-2-6-12-36)18-28(38)35-13-9-26(10-14-35)37-20-23-7-3-4-8-27(23)33-31(37)40/h3-4,7-8,15,17,19,24,26H,2,5-6,9-14,16,18,20H2,1H3,(H,32,34)(H,33,40)