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

Systemtic Name: 2-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[2-(2-methylindolin-1-yl)-2-oxo-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]thio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-keto-2-(2-methylindolin-1-yl)ethyl]thio]-6-propyl-1H-pyrimidin-4-one Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)N2C(CC3=CC=CC=C32)C

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)N2C(CC3=CC=CC=C32)C

InChI

InChI=1S/C18H21N3O2S/c1-3-6-14-10-16(22)20-18(19-14)24-11-17(23)21-12(2)9-13-7-4-5-8-15(13)21/h4-5,7-8,10,12H,3,6,9,11H2,1-2H3,(H,19,20,22)