ethyl 4-methyl-2-[3-[6-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-5-yl]propanoylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[3-[6-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-5-yl]propanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[3-(2-benzylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)propanoylamino]-4-methyl-thiazole-5-carboxylate CAS Name: 4-methyl-2-[[3-[6-methyl-4-oxo-2-(phenylmethylthio)-1H-pyrimidin-5-yl]-1-oxopropyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(2-benzylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)propanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[3-[2-(benzylthio)-4-keto-6-methyl-1H-pyrimidin-5-yl]propanoylamino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C22H24N4O4S2 MolecularWeight: 472.58036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)CCC2=C(NC(=NC2=O)SCC3=CC=CC=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CCC2=C(NC(=NC2=O)SCC3=CC=CC=C3)C)C

InChI

InChI=1S/C22H24N4O4S2/c1-4-30-20(29)18-14(3)24-22(32-18)25-17(27)11-10-16-13(2)23-21(26-19(16)28)31-12-15-8-6-5-7-9-15/h5-9H,4,10-12H2,1-3H3,(H,23,26,28)(H,24,25,27)