tert-butyl N-[4-oxidanylidene-3-[(4-phenylphenyl)methyl]-2-propyl-quinazolin-6-yl]carbamate

Systemtic Name: tert-butyl N-[4-oxidanylidene-3-[(4-phenylphenyl)methyl]-2-propyl-quinazolin-6-yl]carbamate Openeye Name: tert-butyl N-[4-oxo-3-[(4-phenylphenyl)methyl]-2-propyl-quinazolin-6-yl]carbamate CAS Name: N-[4-oxo-3-[(4-phenylphenyl)methyl]-2-propyl-6-quinazolinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-oxo-3-[(4-phenylphenyl)methyl]-2-propylquinazolin-6-yl]carbamate Traditional Name: N-[4-keto-3-(4-phenylbenzyl)-2-propyl-quinazolin-6-yl]carbamic acid tert-butyl ester Formula: C29H31N3O3 MolecularWeight: 469.57474

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=C(C=C2)NC(=O)OC(C)(C)C)C(=O)N1CC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CCCC1=NC2=C(C=C(C=C2)NC(=O)OC(C)(C)C)C(=O)N1CC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H31N3O3/c1-5-9-26-31-25-17-16-23(30-28(34)35-29(2,3)4)18-24(25)27(33)32(26)19-20-12-14-22(15-13-20)21-10-7-6-8-11-21/h6-8,10-18H,5,9,19H2,1-4H3,(H,30,34)