N-[(2-chlorophenyl)carbamoyl]-3,5-bis(methylsulfonyl)-1,2-thiazole-4-carboxamide

Systemtic Name: N-[(2-chlorophenyl)carbamoyl]-3,5-bis(methylsulfonyl)-1,2-thiazole-4-carboxamide Openeye Name: N-[(2-chlorophenyl)carbamoyl]-3,5-bis(methylsulfonyl)isothiazole-4-carboxamide CAS Name: N-[(2-chloroanilino)-oxomethyl]-3,5-bis(methylsulfonyl)-4-isothiazolecarboxamide IUPAC Name: N-[(2-chlorophenyl)carbamoyl]-3,5-bis(methylsulfonyl)-1,2-thiazole-4-carboxamide Traditional Name: N-[(2-chlorophenyl)carbamoyl]-3,5-dimesyl-isothiazole-4-carboxamide Formula: C13H12ClN3O6S3 MolecularWeight: 437.89888

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C(=NS1)S(=O)(=O)C)C(=O)NC(=O)NC2=CC=CC=C2Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C(=NS1)S(=O)(=O)C)C(=O)NC(=O)NC2=CC=CC=C2Cl

InChI

InChI=1S/C13H12ClN3O6S3/c1-25(20,21)11-9(12(24-17-11)26(2,22)23)10(18)16-13(19)15-8-6-4-3-5-7(8)14/h3-6H,1-2H3,(H2,15,16,18,19)