8-methyl-3-[2-[4-(phenylmethyl)piperidin-1-yl]ethyl]-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 8-methyl-3-[2-[4-(phenylmethyl)piperidin-1-yl]ethyl]-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-[2-(4-benzyl-1-piperidyl)ethyl]-8-methyl-5H-pyrimido[5,4-b]indol-4-one CAS Name: 8-methyl-3-[2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 3-[2-(4-benzylpiperidin-1-yl)ethyl]-8-methyl-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-[2-(4-benzylpiperidino)ethyl]-8-methyl-5H-pyrimid[5,4-b]indol-4-one Formula: C25H28N4O MolecularWeight: 400.51602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC3=C2N=CN(C3=O)CCN4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)NC3=C2N=CN(C3=O)CCN4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C25H28N4O/c1-18-7-8-22-21(15-18)23-24(27-22)25(30)29(17-26-23)14-13-28-11-9-20(10-12-28)16-19-5-3-2-4-6-19/h2-8,15,17,20,27H,9-14,16H2,1H3