4-[4-(2-fluorophenyl)piperazin-1-yl]-5,8-dimethyl-pyrimido[5,4-b]indole

Systemtic Name: 4-[4-(2-fluorophenyl)piperazin-1-yl]-5,8-dimethyl-pyrimido[5,4-b]indole Openeye Name: 4-[4-(2-fluorophenyl)piperazin-1-yl]-5,8-dimethyl-pyrimido[5,4-b]indole CAS Name: 4-[4-(2-fluorophenyl)-1-piperazinyl]-5,8-dimethylpyrimido[5,4-b]indole IUPAC Name: 4-[4-(2-fluorophenyl)piperazin-1-yl]-5,8-dimethylpyrimido[5,4-b]indole Traditional Name: 4-[4-(2-fluorophenyl)piperazino]-5,8-dimethyl-pyrimid[5,4-b]indole Formula: C22H22FN5 MolecularWeight: 375.441983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C3=C2N=CN=C3N4CCN(CC4)C5=CC=CC=C5F)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C3=C2N=CN=C3N4CCN(CC4)C5=CC=CC=C5F)C

InChI

InChI=1S/C22H22FN5/c1-15-7-8-18-16(13-15)20-21(26(18)2)22(25-14-24-20)28-11-9-27(10-12-28)19-6-4-3-5-17(19)23/h3-8,13-14H,9-12H2,1-2H3