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

Systemtic Name: ethyl 3-(7-methyl-1H-indazol-5-yl)-2-[[4-(2-oxidanylidene-1,4-dihydroquinazolin-3-yl)piperidin-1-yl]carbonylamino]propanoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C27H32N6O4 MolecularWeight: 504.58078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H32N6O4/c1-3-37-25(34)23(14-18-12-17(2)24-20(13-18)15-28-31-24)30-26(35)32-10-8-21(9-11-32)33-16-19-6-4-5-7-22(19)29-27(33)36/h4-7,12-13,15,21,23H,3,8-11,14,16H2,1-2H3,(H,28,31)(H,29,36)(H,30,35)