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

Systemtic Name: 2-[(4-ethanoylphenyl)sulfonyl-methyl-amino]-N-(6-ethyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[(4-acetylphenyl)sulfonyl-methyl-amino]-N-(6-ethyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[(4-acetylphenyl)sulfonyl-methylamino]-N-(6-ethyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[(4-acetylphenyl)sulfonyl-methylamino]-N-(6-ethyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[(4-acetylphenyl)sulfonyl-methyl-amino]-N-(6-ethyl-1,3-benzothiazol-2-yl)acetamide Formula: C20H21N3O4S2 MolecularWeight: 431.52844

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C20H21N3O4S2/c1-4-14-5-10-17-18(11-14)28-20(21-17)22-19(25)12-23(3)29(26,27)16-8-6-15(7-9-16)13(2)24/h5-11H,4,12H2,1-3H3,(H,21,22,25)