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

Systemtic Name: methyl 3-[(4-ethylsulfanylphenyl)carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-[(4-ethylsulfanylbenzoyl)amino]benzothiophene-2-carboxylate CAS Name: 3-[[[4-(ethylthio)phenyl]-oxomethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[(4-ethylsulfanylbenzoyl)amino]-1-benzothiophene-2-carboxylate Traditional Name: 3-[[4-(ethylthio)benzoyl]amino]benzothiophene-2-carboxylic acid methyl ester Formula: C19H17NO3S2 MolecularWeight: 371.47318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)C(=O)NC2=C(SC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CCSC1=CC=C(C=C1)C(=O)NC2=C(SC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C19H17NO3S2/c1-3-24-13-10-8-12(9-11-13)18(21)20-16-14-6-4-5-7-15(14)25-17(16)19(22)23-2/h4-11H,3H2,1-2H3,(H,20,21)