N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-3-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanamide

Systemtic Name: N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-3-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanamide Openeye Name: N-[4-(4-ethylphenyl)thiazol-2-yl]-3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)propanamide CAS Name: N-[4-(4-ethylphenyl)-2-thiazolyl]-3-[6-methyl-2-(methylthio)-4-oxo-1H-pyrimidin-5-yl]propanamide IUPAC Name: N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)propanamide Traditional Name: N-[4-(4-ethylphenyl)thiazol-2-yl]-3-[4-keto-6-methyl-2-(methylthio)-1H-pyrimidin-5-yl]propionamide Formula: C20H22N4O2S2 MolecularWeight: 414.54428

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCC3=C(NC(=NC3=O)SC)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCC3=C(NC(=NC3=O)SC)C

InChI

InChI=1S/C20H22N4O2S2/c1-4-13-5-7-14(8-6-13)16-11-28-20(22-16)23-17(25)10-9-15-12(2)21-19(27-3)24-18(15)26/h5-8,11H,4,9-10H2,1-3H3,(H,21,24,26)(H,22,23,25)