4-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]-8-fluoranyl-5H-pyrimido[5,4-b]indole

Systemtic Name: 4-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]-8-fluoranyl-5H-pyrimido[5,4-b]indole Openeye Name: 4-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]-8-fluoro-5H-pyrimido[5,4-b]indole CAS Name: 4-[4-[(4-chlorophenyl)-phenylmethyl]-1-piperazinyl]-8-fluoro-5H-pyrimido[5,4-b]indole IUPAC Name: 4-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]-8-fluoro-5H-pyrimido[5,4-b]indole Traditional Name: 4-[4-[(4-chlorophenyl)-phenyl-methyl]piperazino]-8-fluoro-5H-pyrimid[5,4-b]indole Formula: C27H23ClFN5 MolecularWeight: 471.956423

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC3=C2NC4=C3C=C(C=C4)F)C(C5=CC=CC=C5)C6=CC=C(C=C6)Cl

Isomeric SMILES

C1CN(CCN1C2=NC=NC3=C2NC4=C3C=C(C=C4)F)C(C5=CC=CC=C5)C6=CC=C(C=C6)Cl

InChI

InChI=1S/C27H23ClFN5/c28-20-8-6-19(7-9-20)26(18-4-2-1-3-5-18)33-12-14-34(15-13-33)27-25-24(30-17-31-27)22-16-21(29)10-11-23(22)32-25/h1-11,16-17,26,32H,12-15H2