methyl 3-[[4-[cyclopropyl(methyl)sulfamoyl]phenyl]carbonylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-[[4-[cyclopropyl(methyl)sulfamoyl]phenyl]carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-[[4-[cyclopropyl(methyl)sulfamoyl]benzoyl]amino]benzothiophene-2-carboxylate CAS Name: 3-[[[4-[cyclopropyl(methyl)sulfamoyl]phenyl]-oxomethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[[4-[cyclopropyl(methyl)sulfamoyl]benzoyl]amino]-1-benzothiophene-2-carboxylate Traditional Name: 3-[[4-[cyclopropyl(methyl)sulfamoyl]benzoyl]amino]benzothiophene-2-carboxylic acid methyl ester Formula: C21H20N2O5S2 MolecularWeight: 444.5239

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(SC4=CC=CC=C43)C(=O)OC

Isomeric SMILES

CN(C1CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(SC4=CC=CC=C43)C(=O)OC

InChI

InChI=1S/C21H20N2O5S2/c1-23(14-9-10-14)30(26,27)15-11-7-13(8-12-15)20(24)22-18-16-5-3-4-6-17(16)29-19(18)21(25)28-2/h3-8,11-12,14H,9-10H2,1-2H3,(H,22,24)