4-[4-(3-chlorophenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole

Systemtic Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole Openeye Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole CAS Name: 4-[4-(3-chlorophenyl)-1-piperazinyl]-5H-pyrimido[5,4-b]indole IUPAC Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole Traditional Name: 4-[4-(3-chlorophenyl)piperazino]-5H-pyrimid[5,4-b]indole Formula: C20H18ClN5 MolecularWeight: 363.84342

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=NC=NC4=C3NC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=NC=NC4=C3NC5=CC=CC=C54

InChI

InChI=1S/C20H18ClN5/c21-14-4-3-5-15(12-14)25-8-10-26(11-9-25)20-19-18(22-13-23-20)16-6-1-2-7-17(16)24-19/h1-7,12-13,24H,8-11H2