3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-2-methyl-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-2-methyl-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-2-methyl-5H-pyrimido[5,4-b]indol-4-one CAS Name: 3-[3-[4-(2-methoxyphenyl)-1-piperazinyl]propyl]-2-methyl-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-2-methyl-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-[3-[4-(2-methoxyphenyl)piperazino]propyl]-2-methyl-5H-pyrimid[5,4-b]indol-4-one Formula: C25H29N5O2 MolecularWeight: 431.53006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=O)N1CCCN3CCN(CC3)C4=CC=CC=C4OC)NC5=CC=CC=C52

Isomeric SMILES

CC1=NC2=C(C(=O)N1CCCN3CCN(CC3)C4=CC=CC=C4OC)NC5=CC=CC=C52

InChI

InChI=1S/C25H29N5O2/c1-18-26-23-19-8-3-4-9-20(19)27-24(23)25(31)30(18)13-7-12-28-14-16-29(17-15-28)21-10-5-6-11-22(21)32-2/h3-6,8-11,27H,7,12-17H2,1-2H3