tert-butyl 4-[6-[5-(cyclopropylcarbamoyl)-2-methyl-phenyl]-2-oxidanylidene-quinazolin-1-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[6-[5-(cyclopropylcarbamoyl)-2-methyl-phenyl]-2-oxidanylidene-quinazolin-1-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[6-[5-(cyclopropylcarbamoyl)-2-methyl-phenyl]-2-oxo-quinazolin-1-yl]piperidine-1-carboxylate CAS Name: 4-[6-[5-[(cyclopropylamino)-oxomethyl]-2-methylphenyl]-2-oxo-1-quinazolinyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[6-[5-(cyclopropylcarbamoyl)-2-methylphenyl]-2-oxoquinazolin-1-yl]piperidine-1-carboxylate Traditional Name: 4-[6-[5-(cyclopropylcarbamoyl)-2-methyl-phenyl]-2-keto-quinazolin-1-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C29H34N4O4 MolecularWeight: 502.60466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)C3=CC4=C(C=C3)N(C(=O)N=C4)C5CCN(CC5)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)C3=CC4=C(C=C3)N(C(=O)N=C4)C5CCN(CC5)C(=O)OC(C)(C)C

InChI

InChI=1S/C29H34N4O4/c1-18-5-6-20(26(34)31-22-8-9-22)16-24(18)19-7-10-25-21(15-19)17-30-27(35)33(25)23-11-13-32(14-12-23)28(36)37-29(2,3)4/h5-7,10,15-17,22-23H,8-9,11-14H2,1-4H3,(H,31,34)