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

Systemtic Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole Openeye Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole CAS Name: 4-[4-(3-methoxyphenyl)-1-piperazinyl]-5H-pyrimido[5,4-b]indole IUPAC Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole Traditional Name: 4-[4-(3-methoxyphenyl)piperazino]-5H-pyrimid[5,4-b]indole Formula: C21H21N5O MolecularWeight: 359.42434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C3=NC=NC4=C3NC5=CC=CC=C54

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C3=NC=NC4=C3NC5=CC=CC=C54

InChI

InChI=1S/C21H21N5O/c1-27-16-6-4-5-15(13-16)25-9-11-26(12-10-25)21-20-19(22-14-23-21)17-7-2-3-8-18(17)24-20/h2-8,13-14,24H,9-12H2,1H3