methyl 4-methyl-3-[2-(thiophen-2-ylmethylsulfanyl)ethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-(thiophen-2-ylmethylsulfanyl)ethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-(2-thienylmethylsulfanyl)acetyl]amino]benzoate CAS Name: 4-methyl-3-[[1-oxo-2-(thiophen-2-ylmethylthio)ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-(thiophen-2-ylmethylsulfanyl)acetyl]amino]benzoate Traditional Name: 4-methyl-3-[[2-(2-thenylthio)acetyl]amino]benzoic acid methyl ester Formula: C16H17NO3S2 MolecularWeight: 335.44108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSCC2=CC=CS2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSCC2=CC=CS2

InChI

InChI=1S/C16H17NO3S2/c1-11-5-6-12(16(19)20-2)8-14(11)17-15(18)10-21-9-13-4-3-7-22-13/h3-8H,9-10H2,1-2H3,(H,17,18)