2-[(4-chlorophenyl)sulfonyl-methyl-amino]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-[(4-chlorophenyl)sulfonyl-methyl-amino]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[(4-chlorophenyl)sulfonyl-methyl-amino]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[(4-chlorophenyl)sulfonyl-methyl-amino]-N-(6-mesyl-1,3-benzothiazol-2-yl)acetamide Formula: C17H16ClN3O5S3 MolecularWeight: 473.97404

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CN(CC(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H16ClN3O5S3/c1-21(29(25,26)12-5-3-11(18)4-6-12)10-16(22)20-17-19-14-8-7-13(28(2,23)24)9-15(14)27-17/h3-9H,10H2,1-2H3,(H,19,20,22)