tert-butyl 3-(7-methyl-1H-indazol-5-yl)-2-[[4-(2-oxidanylidene-1,4-dihydroquinazolin-3-yl)piperidin-1-yl]carbonylamino]propanoate

Systemtic Name: tert-butyl 3-(7-methyl-1H-indazol-5-yl)-2-[[4-(2-oxidanylidene-1,4-dihydroquinazolin-3-yl)piperidin-1-yl]carbonylamino]propanoate Openeye Name: tert-butyl 3-(7-methyl-1H-indazol-5-yl)-2-[[4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidine-1-carbonyl]amino]propanoate CAS Name: 3-(7-methyl-1H-indazol-5-yl)-2-[[oxo-[4-(2-oxo-1,4-dihydroquinazolin-3-yl)-1-piperidinyl]methyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(7-methyl-1H-indazol-5-yl)-2-[[4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidine-1-carbonyl]amino]propanoate Traditional Name: 2-[[4-(2-keto-1,4-dihydroquinazolin-3-yl)piperidine-1-carbonyl]amino]-3-(7-methyl-1H-indazol-5-yl)propionic acid tert-butyl ester Formula: C29H36N6O4 MolecularWeight: 532.63394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H36N6O4/c1-18-13-19(14-21-16-30-33-25(18)21)15-24(26(36)39-29(2,3)4)32-27(37)34-11-9-22(10-12-34)35-17-20-7-5-6-8-23(20)31-28(35)38/h5-8,13-14,16,22,24H,9-12,15,17H2,1-4H3,(H,30,33)(H,31,38)(H,32,37)