2-cyclohexyl-4-[4-(2-fluorophenyl)piperazin-1-yl]-6,7-dimethoxy-quinazoline

Systemtic Name: 2-cyclohexyl-4-[4-(2-fluorophenyl)piperazin-1-yl]-6,7-dimethoxy-quinazoline Openeye Name: 2-cyclohexyl-4-[4-(2-fluorophenyl)piperazin-1-yl]-6,7-dimethoxy-quinazoline CAS Name: 2-cyclohexyl-4-[4-(2-fluorophenyl)-1-piperazinyl]-6,7-dimethoxyquinazoline IUPAC Name: 2-cyclohexyl-4-[4-(2-fluorophenyl)piperazin-1-yl]-6,7-dimethoxyquinazoline Traditional Name: 2-cyclohexyl-4-[4-(2-fluorophenyl)piperazino]-6,7-dimethoxy-quinazoline Formula: C26H31FN4O2 MolecularWeight: 450.548343

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)C3CCCCC3)N4CCN(CC4)C5=CC=CC=C5F)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)C3CCCCC3)N4CCN(CC4)C5=CC=CC=C5F)OC

InChI

InChI=1S/C26H31FN4O2/c1-32-23-16-19-21(17-24(23)33-2)28-25(18-8-4-3-5-9-18)29-26(19)31-14-12-30(13-15-31)22-11-7-6-10-20(22)27/h6-7,10-11,16-18H,3-5,8-9,12-15H2,1-2H3