3-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-5-(2-chlorophenyl)cyclohex-2-en-1-one

Systemtic Name: 3-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-5-(2-chlorophenyl)cyclohex-2-en-1-one Openeye Name: 3-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-5-(2-chlorophenyl)cyclohex-2-en-1-one CAS Name: 3-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-5-(2-chlorophenyl)-1-cyclohex-2-enone IUPAC Name: 3-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-5-(2-chlorophenyl)cyclohex-2-en-1-one Traditional Name: 3-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazino]-5-(2-chlorophenyl)cyclohex-2-en-1-one Formula: C26H28ClN5O3 MolecularWeight: 493.98522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C4=CC(=O)CC(C4)C5=CC=CC=C5Cl)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C4=CC(=O)CC(C4)C5=CC=CC=C5Cl)N)OC

InChI

InChI=1S/C26H28ClN5O3/c1-34-23-14-20-22(15-24(23)35-2)29-26(30-25(20)28)32-9-7-31(8-10-32)17-11-16(12-18(33)13-17)19-5-3-4-6-21(19)27/h3-6,13-16H,7-12H2,1-2H3,(H2,28,29,30)