2-(4-chlorophenyl)-6,7,8-trimethoxy-4-[4-(phenylmethyl)piperazin-1-yl]quinazoline

Systemtic Name: 2-(4-chlorophenyl)-6,7,8-trimethoxy-4-[4-(phenylmethyl)piperazin-1-yl]quinazoline Openeye Name: 4-(4-benzylpiperazin-1-yl)-2-(4-chlorophenyl)-6,7,8-trimethoxy-quinazoline CAS Name: 2-(4-chlorophenyl)-6,7,8-trimethoxy-4-[4-(phenylmethyl)-1-piperazinyl]quinazoline IUPAC Name: 4-(4-benzylpiperazin-1-yl)-2-(4-chlorophenyl)-6,7,8-trimethoxyquinazoline Traditional Name: 4-(4-benzylpiperazino)-2-(4-chlorophenyl)-6,7,8-trimethoxy-quinazoline Formula: C28H29ClN4O3 MolecularWeight: 505.00786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=C1)C(=NC(=N2)C3=CC=C(C=C3)Cl)N4CCN(CC4)CC5=CC=CC=C5)OC)OC

Isomeric SMILES

COC1=C(C(=C2C(=C1)C(=NC(=N2)C3=CC=C(C=C3)Cl)N4CCN(CC4)CC5=CC=CC=C5)OC)OC

InChI

InChI=1S/C28H29ClN4O3/c1-34-23-17-22-24(26(36-3)25(23)35-2)30-27(20-9-11-21(29)12-10-20)31-28(22)33-15-13-32(14-16-33)18-19-7-5-4-6-8-19/h4-12,17H,13-16,18H2,1-3H3