methyl 2-[[(6S)-3-aminocarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]sulfamoyl]benzoate

Systemtic Name: methyl 2-[[(6S)-3-aminocarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]sulfamoyl]benzoate Openeye Name: methyl 2-[[(6S)-3-carbamoyl-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]sulfamoyl]benzoate CAS Name: 2-[[(6S)-3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[(6S)-3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]sulfamoyl]benzoate Traditional Name: 2-[[(6S)-3-carbamoyl-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]sulfamoyl]benzoic acid methyl ester Formula: C18H20N2O5S2 MolecularWeight: 408.4918

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)N)NS(=O)(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

C[C@H]1CCC2=C(C1)SC(=C2C(=O)N)NS(=O)(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C18H20N2O5S2/c1-10-7-8-11-13(9-10)26-17(15(11)16(19)21)20-27(23,24)14-6-4-3-5-12(14)18(22)25-2/h3-6,10,20H,7-9H2,1-2H3,(H2,19,21)/t10-/m0/s1