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

Systemtic Name: 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)ethanamide Openeye Name: 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)acetamide CAS Name: 2-[(4-acetamidophenyl)sulfonyl-methylamino]-N-[2-(methylthio)-1,3-benzothiazol-6-yl]acetamide IUPAC Name: 2-[(4-acetamidophenyl)sulfonyl-methylamino]-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)acetamide Traditional Name: 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]-N-[2-(methylthio)-1,3-benzothiazol-6-yl]acetamide Formula: C19H20N4O4S3 MolecularWeight: 464.5815

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2=CC3=C(C=C2)N=C(S3)SC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2=CC3=C(C=C2)N=C(S3)SC

InChI

InChI=1S/C19H20N4O4S3/c1-12(24)20-13-4-7-15(8-5-13)30(26,27)23(2)11-18(25)21-14-6-9-16-17(10-14)29-19(22-16)28-3/h4-10H,11H2,1-3H3,(H,20,24)(H,21,25)