9-methoxy-4-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole

Systemtic Name: 9-methoxy-4-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole Openeye Name: 9-methoxy-4-[3-methyl-4-(m-tolyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole CAS Name: 9-methoxy-4-[3-methyl-4-(3-methylphenyl)-1-piperazinyl]-5H-pyrimido[5,4-b]indole IUPAC Name: 9-methoxy-4-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole Traditional Name: 9-methoxy-4-[3-methyl-4-(m-tolyl)piperazino]-5H-pyrimid[5,4-b]indole Formula: C23H25N5O MolecularWeight: 387.4775

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=CC(=C2)C)C3=NC=NC4=C3NC5=C4C(=CC=C5)OC

Isomeric SMILES

CC1CN(CCN1C2=CC=CC(=C2)C)C3=NC=NC4=C3NC5=C4C(=CC=C5)OC

InChI

InChI=1S/C23H25N5O/c1-15-6-4-7-17(12-15)28-11-10-27(13-16(28)2)23-22-21(24-14-25-23)20-18(26-22)8-5-9-19(20)29-3/h4-9,12,14,16,26H,10-11,13H2,1-3H3