2-[3-methyl-6-oxidanylidene-1-(phenylmethyl)piperidin-2-yl]-3-(phenylmethyl)-7H-pyrrolo[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[3-methyl-6-oxidanylidene-1-(phenylmethyl)piperidin-2-yl]-3-(phenylmethyl)-7H-pyrrolo[3,2-d]pyrimidin-4-one Openeye Name: 3-benzyl-2-(1-benzyl-3-methyl-6-oxo-2-piperidyl)-7H-pyrrolo[3,2-d]pyrimidin-4-one CAS Name: 2-[3-methyl-6-oxo-1-(phenylmethyl)-2-piperidinyl]-3-(phenylmethyl)-7H-pyrrolo[3,2-d]pyrimidin-4-one IUPAC Name: 3-benzyl-2-(1-benzyl-3-methyl-6-oxopiperidin-2-yl)-7H-pyrrolo[3,2-d]pyrimidin-4-one Traditional Name: 3-benzyl-2-(1-benzyl-6-keto-3-methyl-2-piperidyl)-7H-pyrrolo[3,2-d]pyrimidin-4-one Formula: C26H26N4O2 MolecularWeight: 426.51024

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(=O)N(C1C2=NC3=C(C(=O)N2CC4=CC=CC=C4)N=CC3)CC5=CC=CC=C5

Isomeric SMILES

CC1CCC(=O)N(C1C2=NC3=C(C(=O)N2CC4=CC=CC=C4)N=CC3)CC5=CC=CC=C5

InChI

InChI=1S/C26H26N4O2/c1-18-12-13-22(31)29(16-19-8-4-2-5-9-19)24(18)25-28-21-14-15-27-23(21)26(32)30(25)17-20-10-6-3-7-11-20/h2-11,15,18,24H,12-14,16-17H2,1H3