8-bromanyl-4-[4-(2-methoxyphenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole

Systemtic Name: 8-bromanyl-4-[4-(2-methoxyphenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole Openeye Name: 8-bromo-4-[4-(2-methoxyphenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole CAS Name: 8-bromo-4-[4-(2-methoxyphenyl)-1-piperazinyl]-5H-pyrimido[5,4-b]indole IUPAC Name: 8-bromo-4-[4-(2-methoxyphenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole Traditional Name: 8-bromo-4-[4-(2-methoxyphenyl)piperazino]-5H-pyrimid[5,4-b]indole Formula: C21H20BrN5O MolecularWeight: 438.3204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3=NC=NC4=C3NC5=C4C=C(C=C5)Br

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3=NC=NC4=C3NC5=C4C=C(C=C5)Br

InChI

InChI=1S/C21H20BrN5O/c1-28-18-5-3-2-4-17(18)26-8-10-27(11-9-26)21-20-19(23-13-24-21)15-12-14(22)6-7-16(15)25-20/h2-7,12-13,25H,8-11H2,1H3