1-[3-azanyl-5-methylsulfanyl-4-(phenylsulfonyl)thiophen-2-yl]ethanone

Systemtic Name: 1-[3-azanyl-5-methylsulfanyl-4-(phenylsulfonyl)thiophen-2-yl]ethanone Openeye Name: 1-[3-amino-4-(benzenesulfonyl)-5-methylsulfanyl-2-thienyl]ethanone CAS Name: 1-[3-amino-4-(benzenesulfonyl)-5-(methylthio)-2-thiophenyl]ethanone IUPAC Name: 1-[3-amino-4-(benzenesulfonyl)-5-methylsulfanylthiophen-2-yl]ethanone Traditional Name: 1-[3-amino-4-besyl-5-(methylthio)-2-thienyl]ethanone Formula: C13H13NO3S3 MolecularWeight: 327.44222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=C(S1)SC)S(=O)(=O)C2=CC=CC=C2)N

Isomeric SMILES

CC(=O)C1=C(C(=C(S1)SC)S(=O)(=O)C2=CC=CC=C2)N

InChI

InChI=1S/C13H13NO3S3/c1-8(15)11-10(14)12(13(18-2)19-11)20(16,17)9-6-4-3-5-7-9/h3-7H,14H2,1-2H3