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

Systemtic Name: 4-[4-(3,4-dichlorophenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole Openeye Name: 4-[4-(3,4-dichlorophenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole CAS Name: 4-[4-(3,4-dichlorophenyl)-1-piperazinyl]-5H-pyrimido[5,4-b]indole IUPAC Name: 4-[4-(3,4-dichlorophenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole Traditional Name: 4-[4-(3,4-dichlorophenyl)piperazino]-5H-pyrimid[5,4-b]indole Formula: C20H17Cl2N5 MolecularWeight: 398.28848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17Cl2N5/c21-15-6-5-13(11-16(15)22)26-7-9-27(10-8-26)20-19-18(23-12-24-20)14-3-1-2-4-17(14)25-19/h1-6,11-12,25H,7-10H2