methyl 3-[[3-(1,3-dithian-2-yl)phenyl]sulfamoyl]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[3-(1,3-dithian-2-yl)phenyl]sulfamoyl]thiophene-2-carboxylate Openeye Name: methyl 3-[[3-(1,3-dithian-2-yl)phenyl]sulfamoyl]thiophene-2-carboxylate CAS Name: 3-[[3-(1,3-dithian-2-yl)phenyl]sulfamoyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[3-(1,3-dithian-2-yl)phenyl]sulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[[3-(1,3-dithian-2-yl)phenyl]sulfamoyl]thiophene-2-carboxylic acid methyl ester Formula: C16H17NO4S4 MolecularWeight: 415.57048

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=CC=CC(=C2)C3SCCCS3

Isomeric SMILES

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=CC=CC(=C2)C3SCCCS3

InChI

InChI=1S/C16H17NO4S4/c1-21-15(18)14-13(6-9-22-14)25(19,20)17-12-5-2-4-11(10-12)16-23-7-3-8-24-16/h2,4-6,9-10,16-17H,3,7-8H2,1H3