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

Systemtic Name: ethyl 4-methyl-2-[2-[4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-6-yl]ethanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[2-(2-benzylsulfanyl-4-oxo-1H-pyrimidin-6-yl)acetyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 4-methyl-2-[[1-oxo-2-[4-oxo-2-(phenylmethylthio)-1H-pyrimidin-6-yl]ethyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2-benzylsulfanyl-4-oxo-1H-pyrimidin-6-yl)acetyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-[2-(benzylthio)-4-keto-1H-pyrimidin-6-yl]acetyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C20H20N4O4S2 MolecularWeight: 444.5272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)CC2=CC(=O)N=C(N2)SCC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CC2=CC(=O)N=C(N2)SCC3=CC=CC=C3)C

InChI

InChI=1S/C20H20N4O4S2/c1-3-28-18(27)17-12(2)21-20(30-17)24-16(26)10-14-9-15(25)23-19(22-14)29-11-13-7-5-4-6-8-13/h4-9H,3,10-11H2,1-2H3,(H,21,24,26)(H,22,23,25)