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

Systemtic Name: 8-methyl-3-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]-8-methyl-5H-pyrimido[5,4-b]indol-4-one CAS Name: 8-methyl-3-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 3-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-8-methyl-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-[2-(4-benzylpiperazino)-2-keto-ethyl]-8-methyl-5H-pyrimid[5,4-b]indol-4-one Formula: C24H25N5O2 MolecularWeight: 415.4876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC3=C2N=CN(C3=O)CC(=O)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)NC3=C2N=CN(C3=O)CC(=O)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C24H25N5O2/c1-17-7-8-20-19(13-17)22-23(26-20)24(31)29(16-25-22)15-21(30)28-11-9-27(10-12-28)14-18-5-3-2-4-6-18/h2-8,13,16,26H,9-12,14-15H2,1H3