2-[2-[4-(3-fluorophenyl)piperazin-1-yl]ethyl]-6,7-dimethoxy-1H-quinazolin-4-one

Systemtic Name: 2-[2-[4-(3-fluorophenyl)piperazin-1-yl]ethyl]-6,7-dimethoxy-1H-quinazolin-4-one Openeye Name: 2-[2-[4-(3-fluorophenyl)piperazin-1-yl]ethyl]-6,7-dimethoxy-1H-quinazolin-4-one CAS Name: 2-[2-[4-(3-fluorophenyl)-1-piperazinyl]ethyl]-6,7-dimethoxy-1H-quinazolin-4-one IUPAC Name: 2-[2-[4-(3-fluorophenyl)piperazin-1-yl]ethyl]-6,7-dimethoxy-1H-quinazolin-4-one Traditional Name: 2-[2-[4-(3-fluorophenyl)piperazino]ethyl]-6,7-dimethoxy-1H-quinazolin-4-one Formula: C22H25FN4O3 MolecularWeight: 412.457303

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N=C(N2)CCN3CCN(CC3)C4=CC(=CC=C4)F)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N=C(N2)CCN3CCN(CC3)C4=CC(=CC=C4)F)OC

InChI

InChI=1S/C22H25FN4O3/c1-29-19-13-17-18(14-20(19)30-2)24-21(25-22(17)28)6-7-26-8-10-27(11-9-26)16-5-3-4-15(23)12-16/h3-5,12-14H,6-11H2,1-2H3,(H,24,25,28)