2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]sulfanyl-1-(2-methylpropyl)-6-oxidanyl-pyrimidin-4-one

Systemtic Name: 2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]sulfanyl-1-(2-methylpropyl)-6-oxidanyl-pyrimidin-4-one Openeye Name: 2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]sulfanyl-6-hydroxy-1-isobutyl-pyrimidin-4-one CAS Name: 2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]thio]-6-hydroxy-1-(2-methylpropyl)-4-pyrimidinone IUPAC Name: 2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]sulfanyl-6-hydroxy-1-(2-methylpropyl)pyrimidin-4-one Traditional Name: 2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]thio]-6-hydroxy-1-isobutyl-pyrimidin-4-one Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CC(=O)N=C1SCC(=O)N2CCC3=CC=CC=C3C2)O

Isomeric SMILES

CC(C)CN1C(=CC(=O)N=C1SCC(=O)N2CCC3=CC=CC=C3C2)O

InChI

InChI=1S/C19H23N3O3S/c1-13(2)10-22-17(24)9-16(23)20-19(22)26-12-18(25)21-8-7-14-5-3-4-6-15(14)11-21/h3-6,9,13,24H,7-8,10-12H2,1-2H3