[2-(4-chlorophenyl)-2-oxidanylidene-ethyl] 3-azanyl-4-propan-2-ylsulfonyl-thiophene-2-carboxylate

Systemtic Name: [2-(4-chlorophenyl)-2-oxidanylidene-ethyl] 3-azanyl-4-propan-2-ylsulfonyl-thiophene-2-carboxylate Openeye Name: [2-(4-chlorophenyl)-2-oxo-ethyl] 3-amino-4-isopropylsulfonyl-thiophene-2-carboxylate CAS Name: 3-amino-4-propan-2-ylsulfonyl-2-thiophenecarboxylic acid [2-(4-chlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-chlorophenyl)-2-oxoethyl] 3-amino-4-propan-2-ylsulfonylthiophene-2-carboxylate Traditional Name: 3-amino-4-isopropylsulfonyl-thiophene-2-carboxylic acid [2-(4-chlorophenyl)-2-keto-ethyl] ester Formula: C16H16ClNO5S2 MolecularWeight: 401.88494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CSC(=C1N)C(=O)OCC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)S(=O)(=O)C1=CSC(=C1N)C(=O)OCC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H16ClNO5S2/c1-9(2)25(21,22)13-8-24-15(14(13)18)16(20)23-7-12(19)10-3-5-11(17)6-4-10/h3-6,8-9H,7,18H2,1-2H3