3-methyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-one

Systemtic Name: 3-methyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-one Openeye Name: 3-methyl-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-one CAS Name: 3-methyl-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-one IUPAC Name: 3-methyl-2-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-one Traditional Name: 2-[(2-keto-2-piperidino-ethyl)thio]-3-methyl-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-one Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C(=CN2)C3=CC=CC=C3)N=C1SCC(=O)N4CCCCC4

Isomeric SMILES

CN1C(=O)C2=C(C(=CN2)C3=CC=CC=C3)N=C1SCC(=O)N4CCCCC4

InChI

InChI=1S/C20H22N4O2S/c1-23-19(26)18-17(15(12-21-18)14-8-4-2-5-9-14)22-20(23)27-13-16(25)24-10-6-3-7-11-24/h2,4-5,8-9,12,21H,3,6-7,10-11,13H2,1H3