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

Systemtic Name: 3-butyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-one Openeye Name: 3-butyl-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-one CAS Name: 3-butyl-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-one IUPAC Name: 3-butyl-2-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-one Traditional Name: 3-butyl-2-[(2-keto-2-piperidino-ethyl)thio]-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-one Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C(=CN2)C3=CC=CC=C3)N=C1SCC(=O)N4CCCCC4

Isomeric SMILES

CCCCN1C(=O)C2=C(C(=CN2)C3=CC=CC=C3)N=C1SCC(=O)N4CCCCC4

InChI

InChI=1S/C23H28N4O2S/c1-2-3-14-27-22(29)21-20(18(15-24-21)17-10-6-4-7-11-17)25-23(27)30-16-19(28)26-12-8-5-9-13-26/h4,6-7,10-11,15,24H,2-3,5,8-9,12-14,16H2,1H3