tert-butyl 4-[(4-oxidanylidene-3-phenyl-quinazolin-2-yl)methyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(4-oxidanylidene-3-phenyl-quinazolin-2-yl)methyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(4-oxo-3-phenyl-quinazolin-2-yl)methyl]piperazine-1-carboxylate CAS Name: 4-[(4-oxo-3-phenyl-2-quinazolinyl)methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(4-oxo-3-phenylquinazolin-2-yl)methyl]piperazine-1-carboxylate Traditional Name: 4-[(4-keto-3-phenyl-quinazolin-2-yl)methyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C24H28N4O3 MolecularWeight: 420.50412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C24H28N4O3/c1-24(2,3)31-23(30)27-15-13-26(14-16-27)17-21-25-20-12-8-7-11-19(20)22(29)28(21)18-9-5-4-6-10-18/h4-12H,13-17H2,1-3H3