methyl 2-(2-phenylsulfanylethanoylamino)-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-(2-phenylsulfanylethanoylamino)-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[(2-phenylsulfanylacetyl)amino]thiazole-5-carboxylate CAS Name: 2-[[1-oxo-2-(phenylthio)ethyl]amino]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2-phenylsulfanylacetyl)amino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-(phenylthio)acetyl]amino]thiazole-5-carboxylic acid methyl ester Formula: C13H12N2O3S2 MolecularWeight: 308.37598

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(S1)NC(=O)CSC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CN=C(S1)NC(=O)CSC2=CC=CC=C2

InChI

InChI=1S/C13H12N2O3S2/c1-18-12(17)10-7-14-13(20-10)15-11(16)8-19-9-5-3-2-4-6-9/h2-7H,8H2,1H3,(H,14,15,16)