4-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-8-methoxy-5H-pyrimido[5,4-b]indole

Systemtic Name: 4-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-8-methoxy-5H-pyrimido[5,4-b]indole Openeye Name: 4-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-8-methoxy-5H-pyrimido[5,4-b]indole CAS Name: 4-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-8-methoxy-5H-pyrimido[5,4-b]indole IUPAC Name: 4-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-8-methoxy-5H-pyrimido[5,4-b]indole Traditional Name: 4-[4-(5-chloro-2-methyl-phenyl)piperazino]-8-methoxy-5H-pyrimid[5,4-b]indole Formula: C22H22ClN5O MolecularWeight: 407.89598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C3=NC=NC4=C3NC5=C4C=C(C=C5)OC

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C3=NC=NC4=C3NC5=C4C=C(C=C5)OC

InChI

InChI=1S/C22H22ClN5O/c1-14-3-4-15(23)11-19(14)27-7-9-28(10-8-27)22-21-20(24-13-25-22)17-12-16(29-2)5-6-18(17)26-21/h3-6,11-13,26H,7-10H2,1-2H3