1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-2-cyclopentyl-2-phenyl-ethanone

Systemtic Name: 1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-2-cyclopentyl-2-phenyl-ethanone Openeye Name: 1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-2-cyclopentyl-2-phenyl-ethanone CAS Name: 1-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-2-cyclopentyl-2-phenylethanone IUPAC Name: 1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-2-cyclopentyl-2-phenylethanone Traditional Name: 1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazino]-2-cyclopentyl-2-phenyl-ethanone Formula: C27H33N5O3 MolecularWeight: 475.58262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)C(C4CCCC4)C5=CC=CC=C5)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)C(C4CCCC4)C5=CC=CC=C5)N)OC

InChI

InChI=1S/C27H33N5O3/c1-34-22-16-20-21(17-23(22)35-2)29-27(30-25(20)28)32-14-12-31(13-15-32)26(33)24(19-10-6-7-11-19)18-8-4-3-5-9-18/h3-5,8-9,16-17,19,24H,6-7,10-15H2,1-2H3,(H2,28,29,30)