3-[6-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxidanylidene-hexyl]-6,7-dimethoxy-1H-quinazoline-2,4-dione

Systemtic Name: 3-[6-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxidanylidene-hexyl]-6,7-dimethoxy-1H-quinazoline-2,4-dione Openeye Name: 3-[6-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxo-hexyl]-6,7-dimethoxy-1H-quinazoline-2,4-dione CAS Name: 3-[6-[4-(4-fluorophenyl)-1-piperazinyl]-6-oxohexyl]-6,7-dimethoxy-1H-quinazoline-2,4-dione IUPAC Name: 3-[6-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxohexyl]-6,7-dimethoxy-1H-quinazoline-2,4-dione Traditional Name: 3-[6-[4-(4-fluorophenyl)piperazino]-6-keto-hexyl]-6,7-dimethoxy-1H-quinazoline-2,4-quinone Formula: C26H31FN4O5 MolecularWeight: 498.546543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N(C(=O)N2)CCCCCC(=O)N3CCN(CC3)C4=CC=C(C=C4)F)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N(C(=O)N2)CCCCCC(=O)N3CCN(CC3)C4=CC=C(C=C4)F)OC

InChI

InChI=1S/C26H31FN4O5/c1-35-22-16-20-21(17-23(22)36-2)28-26(34)31(25(20)33)11-5-3-4-6-24(32)30-14-12-29(13-15-30)19-9-7-18(27)8-10-19/h7-10,16-17H,3-6,11-15H2,1-2H3,(H,28,34)