2-[2-[5-(2-methyl-1,3-thiazol-4-yl)-2,3-dihydroindol-1-yl]-2-oxidanylidene-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-[5-(2-methyl-1,3-thiazol-4-yl)-2,3-dihydroindol-1-yl]-2-oxidanylidene-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[2-[5-(2-methylthiazol-4-yl)indolin-1-yl]-2-oxo-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[2-[5-(2-methyl-4-thiazolyl)-2,3-dihydroindol-1-yl]-2-oxoethyl]thio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-[5-(2-methyl-1,3-thiazol-4-yl)-2,3-dihydroindol-1-yl]-2-oxoethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-keto-2-[5-(2-methylthiazol-4-yl)indolin-1-yl]ethyl]thio]-6-propyl-1H-pyrimidin-4-one Formula: C21H22N4O2S2 MolecularWeight: 426.55498

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)N2CCC3=C2C=CC(=C3)C4=CSC(=N4)C

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)N2CCC3=C2C=CC(=C3)C4=CSC(=N4)C

InChI

InChI=1S/C21H22N4O2S2/c1-3-4-16-10-19(26)24-21(23-16)29-12-20(27)25-8-7-15-9-14(5-6-18(15)25)17-11-28-13(2)22-17/h5-6,9-11H,3-4,7-8,12H2,1-2H3,(H,23,24,26)