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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SC)CCC(=O)N2CCC3=C2C=CC(=C3)C4=CSC(=N4)C

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SC)CCC(=O)N2CCC3=C2C=CC(=C3)C4=CSC(=N4)C

InChI

InChI=1S/C21H22N4O2S2/c1-12-16(20(27)24-21(22-12)28-3)5-7-19(26)25-9-8-15-10-14(4-6-18(15)25)17-11-29-13(2)23-17/h4,6,10-11H,5,7-9H2,1-3H3,(H,22,24,27)