methyl 2-[[[(5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbonylamino]sulfamoyl]benzoate

Systemtic Name: methyl 2-[[[(5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbonylamino]sulfamoyl]benzoate Openeye Name: methyl 2-[[[(5S)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]amino]sulfamoyl]benzoate CAS Name: 2-[[[[(5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-oxomethyl]amino]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[[(5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl]amino]sulfamoyl]benzoate Traditional Name: 2-[[[(5S)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]amino]sulfamoyl]benzoic acid methyl ester Formula: C18H20N2O5S2 MolecularWeight: 408.4918

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NNS(=O)(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

C[C@H]1CCC2=C(C1)C=C(S2)C(=O)NNS(=O)(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C18H20N2O5S2/c1-11-7-8-14-12(9-11)10-15(26-14)17(21)19-20-27(23,24)16-6-4-3-5-13(16)18(22)25-2/h3-6,10-11,20H,7-9H2,1-2H3,(H,19,21)/t11-/m0/s1