methyl 3-[1-oxidanyl-4-(thiophen-2-ylsulfonylamino)naphthalen-2-yl]sulfanylpropanoate

Systemtic Name: methyl 3-[1-oxidanyl-4-(thiophen-2-ylsulfonylamino)naphthalen-2-yl]sulfanylpropanoate Openeye Name: methyl 3-[[1-hydroxy-4-(2-thienylsulfonylamino)-2-naphthyl]sulfanyl]propanoate CAS Name: 3-[[1-hydroxy-4-(thiophen-2-ylsulfonylamino)-2-naphthalenyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[1-hydroxy-4-(thiophen-2-ylsulfonylamino)naphthalen-2-yl]sulfanylpropanoate Traditional Name: 3-[[1-hydroxy-4-(2-thienylsulfonylamino)-2-naphthyl]thio]propionic acid methyl ester Formula: C18H17NO5S3 MolecularWeight: 423.52628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1=C(C2=CC=CC=C2C(=C1)NS(=O)(=O)C3=CC=CS3)O

Isomeric SMILES

COC(=O)CCSC1=C(C2=CC=CC=C2C(=C1)NS(=O)(=O)C3=CC=CS3)O

InChI

InChI=1S/C18H17NO5S3/c1-24-16(20)8-10-25-15-11-14(12-5-2-3-6-13(12)18(15)21)19-27(22,23)17-7-4-9-26-17/h2-7,9,11,19,21H,8,10H2,1H3