methyl 3-[(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)sulfamoyl]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)sulfamoyl]thiophene-2-carboxylate Openeye Name: methyl 3-[[4-chloro-3-(1-piperidylsulfonyl)phenyl]sulfamoyl]thiophene-2-carboxylate CAS Name: 3-[[4-chloro-3-(1-piperidinylsulfonyl)phenyl]sulfamoyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(4-chloro-3-piperidin-1-ylsulfonylphenyl)sulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[(4-chloro-3-piperidinosulfonyl-phenyl)sulfamoyl]thiophene-2-carboxylic acid methyl ester Formula: C17H19ClN2O6S3 MolecularWeight: 478.99056

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C17H19ClN2O6S3/c1-26-17(21)16-14(7-10-27-16)28(22,23)19-12-5-6-13(18)15(11-12)29(24,25)20-8-3-2-4-9-20/h5-7,10-11,19H,2-4,8-9H2,1H3