methyl 2-[(4-methylsulfanylphenyl)carbonylamino]-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 2-[(4-methylsulfanylphenyl)carbonylamino]-1-benzothiophene-3-carboxylate Openeye Name: methyl 2-[(4-methylsulfanylbenzoyl)amino]benzothiophene-3-carboxylate CAS Name: 2-[[[4-(methylthio)phenyl]-oxomethyl]amino]-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[(4-methylsulfanylbenzoyl)amino]-1-benzothiophene-3-carboxylate Traditional Name: 2-[[4-(methylthio)benzoyl]amino]benzothiophene-3-carboxylic acid methyl ester Formula: C18H15NO3S2 MolecularWeight: 357.4466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

COC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C18H15NO3S2/c1-22-18(21)15-13-5-3-4-6-14(13)24-17(15)19-16(20)11-7-9-12(23-2)10-8-11/h3-10H,1-2H3,(H,19,20)