4-[4-(2-fluorophenyl)piperazin-1-yl]-7-methyl-5H-pyrimido[5,4-b]indole

Systemtic Name: 4-[4-(2-fluorophenyl)piperazin-1-yl]-7-methyl-5H-pyrimido[5,4-b]indole Openeye Name: 4-[4-(2-fluorophenyl)piperazin-1-yl]-7-methyl-5H-pyrimido[5,4-b]indole CAS Name: 4-[4-(2-fluorophenyl)-1-piperazinyl]-7-methyl-5H-pyrimido[5,4-b]indole IUPAC Name: 4-[4-(2-fluorophenyl)piperazin-1-yl]-7-methyl-5H-pyrimido[5,4-b]indole Traditional Name: 4-[4-(2-fluorophenyl)piperazino]-7-methyl-5H-pyrimid[5,4-b]indole Formula: C21H20FN5 MolecularWeight: 361.415403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C3=C(N2)C(=NC=N3)N4CCN(CC4)C5=CC=CC=C5F

Isomeric SMILES

CC1=CC2=C(C=C1)C3=C(N2)C(=NC=N3)N4CCN(CC4)C5=CC=CC=C5F

InChI

InChI=1S/C21H20FN5/c1-14-6-7-15-17(12-14)25-20-19(15)23-13-24-21(20)27-10-8-26(9-11-27)18-5-3-2-4-16(18)22/h2-7,12-13,25H,8-11H2,1H3