methyl 5-[2-(2,5-dimethylphenyl)sulfanylethanoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 5-[2-(2,5-dimethylphenyl)sulfanylethanoylamino]thiophene-2-carboxylate Openeye Name: methyl 5-[[2-(2,5-dimethylphenyl)sulfanylacetyl]amino]thiophene-2-carboxylate CAS Name: 5-[[2-[(2,5-dimethylphenyl)thio]-1-oxoethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[[2-(2,5-dimethylphenyl)sulfanylacetyl]amino]thiophene-2-carboxylate Traditional Name: 5-[[2-[(2,5-dimethylphenyl)thio]acetyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C16H17NO3S2 MolecularWeight: 335.44108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCC(=O)NC2=CC=C(S2)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCC(=O)NC2=CC=C(S2)C(=O)OC

InChI

InChI=1S/C16H17NO3S2/c1-10-4-5-11(2)13(8-10)21-9-14(18)17-15-7-6-12(22-15)16(19)20-3/h4-8H,9H2,1-3H3,(H,17,18)