methyl 3-[(3-azanyl-3-oxidanylidene-propyl)-(phenylmethyl)sulfamoyl]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(3-azanyl-3-oxidanylidene-propyl)-(phenylmethyl)sulfamoyl]thiophene-2-carboxylate Openeye Name: methyl 3-[(3-amino-3-oxo-propyl)-benzyl-sulfamoyl]thiophene-2-carboxylate CAS Name: 3-[(3-amino-3-oxopropyl)-(phenylmethyl)sulfamoyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(3-amino-3-oxopropyl)-benzylsulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[(3-amino-3-keto-propyl)-benzyl-sulfamoyl]thiophene-2-carboxylic acid methyl ester Formula: C16H18N2O5S2 MolecularWeight: 382.45452

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)S(=O)(=O)N(CCC(=O)N)CC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=C(C=CS1)S(=O)(=O)N(CCC(=O)N)CC2=CC=CC=C2

InChI

InChI=1S/C16H18N2O5S2/c1-23-16(20)15-13(8-10-24-15)25(21,22)18(9-7-14(17)19)11-12-5-3-2-4-6-12/h2-6,8,10H,7,9,11H2,1H3,(H2,17,19)