2-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-6-ethyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-6-ethyl-1H-pyrimidin-4-one Openeye Name: 6-ethyl-2-(2-indolin-1-yl-2-oxo-ethyl)sulfanyl-1H-pyrimidin-4-one CAS Name: 2-[[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]thio]-6-ethyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-6-ethyl-1H-pyrimidin-4-one Traditional Name: 6-ethyl-2-[(2-indolin-1-yl-2-keto-ethyl)thio]-1H-pyrimidin-4-one Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)N=C(N1)SCC(=O)N2CCC3=CC=CC=C32

Isomeric SMILES

CCC1=CC(=O)N=C(N1)SCC(=O)N2CCC3=CC=CC=C32

InChI

InChI=1S/C16H17N3O2S/c1-2-12-9-14(20)18-16(17-12)22-10-15(21)19-8-7-11-5-3-4-6-13(11)19/h3-6,9H,2,7-8,10H2,1H3,(H,17,18,20)