2-chloranyl-4-[4-(diphenylmethyl)piperazin-1-yl]-6,7-dimethoxy-quinazoline

Systemtic Name: 2-chloranyl-4-[4-(diphenylmethyl)piperazin-1-yl]-6,7-dimethoxy-quinazoline Openeye Name: 4-(4-benzhydrylpiperazin-1-yl)-2-chloro-6,7-dimethoxy-quinazoline CAS Name: 2-chloro-4-[4-(diphenylmethyl)-1-piperazinyl]-6,7-dimethoxyquinazoline IUPAC Name: 4-(4-benzhydrylpiperazin-1-yl)-2-chloro-6,7-dimethoxyquinazoline Traditional Name: 4-(4-benzhydrylpiperazino)-2-chloro-6,7-dimethoxy-quinazoline Formula: C27H27ClN4O2 MolecularWeight: 474.98188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)OC

InChI

InChI=1S/C27H27ClN4O2/c1-33-23-17-21-22(18-24(23)34-2)29-27(28)30-26(21)32-15-13-31(14-16-32)25(19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-12,17-18,25H,13-16H2,1-2H3