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

Systemtic Name: 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[(4-acetamidophenyl)sulfonyl-methylamino]-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[(4-acetamidophenyl)sulfonyl-methylamino]-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)acetamide Formula: C20H22N4O4S2 MolecularWeight: 446.54308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C)C

InChI

InChI=1S/C20H22N4O4S2/c1-12-9-13(2)19-17(10-12)29-20(23-19)22-18(26)11-24(4)30(27,28)16-7-5-15(6-8-16)21-14(3)25/h5-10H,11H2,1-4H3,(H,21,25)(H,22,23,26)