3-[[4-(methoxymethyl)-6-oxidanylidene-5H-pyrimidin-2-yl]sulfanyl]-4-phenyl-1H-quinolin-2-one

Systemtic Name: 3-[[4-(methoxymethyl)-6-oxidanylidene-5H-pyrimidin-2-yl]sulfanyl]-4-phenyl-1H-quinolin-2-one Openeye Name: 3-[[4-(methoxymethyl)-6-oxo-5H-pyrimidin-2-yl]sulfanyl]-4-phenyl-1H-quinolin-2-one CAS Name: 3-[[4-(methoxymethyl)-6-oxo-5H-pyrimidin-2-yl]thio]-4-phenyl-1H-quinolin-2-one IUPAC Name: 3-[[4-(methoxymethyl)-6-oxo-5H-pyrimidin-2-yl]sulfanyl]-4-phenyl-1H-quinolin-2-one Traditional Name: 3-[[4-keto-6-(methoxymethyl)-5H-pyrimidin-2-yl]thio]-4-phenyl-carbostyril Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=NC(=NC(=O)C1)SC2=C(C3=CC=CC=C3NC2=O)C4=CC=CC=C4

Isomeric SMILES

COCC1=NC(=NC(=O)C1)SC2=C(C3=CC=CC=C3NC2=O)C4=CC=CC=C4

InChI

InChI=1S/C21H17N3O3S/c1-27-12-14-11-17(25)24-21(22-14)28-19-18(13-7-3-2-4-8-13)15-9-5-6-10-16(15)23-20(19)26/h2-10H,11-12H2,1H3,(H,23,26)