4-[4-(4-fluorophenyl)piperazin-1-yl]-8-methoxy-5-methyl-pyrimido[5,4-b]indole

Systemtic Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-8-methoxy-5-methyl-pyrimido[5,4-b]indole Openeye Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-8-methoxy-5-methyl-pyrimido[5,4-b]indole CAS Name: 4-[4-(4-fluorophenyl)-1-piperazinyl]-8-methoxy-5-methylpyrimido[5,4-b]indole IUPAC Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-8-methoxy-5-methylpyrimido[5,4-b]indole Traditional Name: 4-[4-(4-fluorophenyl)piperazino]-8-methoxy-5-methyl-pyrimid[5,4-b]indole Formula: C22H22FN5O MolecularWeight: 391.441383

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)OC)C3=C1C(=NC=N3)N4CCN(CC4)C5=CC=C(C=C5)F

Isomeric SMILES

CN1C2=C(C=C(C=C2)OC)C3=C1C(=NC=N3)N4CCN(CC4)C5=CC=C(C=C5)F

InChI

InChI=1S/C22H22FN5O/c1-26-19-8-7-17(29-2)13-18(19)20-21(26)22(25-14-24-20)28-11-9-27(10-12-28)16-5-3-15(23)4-6-16/h3-8,13-14H,9-12H2,1-2H3