N-(6-ethyl-1,3-benzothiazol-2-yl)-2-[2-[(4-methylphenyl)sulfonylamino]ethanoylamino]ethanamide

Systemtic Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-2-[2-[(4-methylphenyl)sulfonylamino]ethanoylamino]ethanamide Openeye Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-2-[[2-(p-tolylsulfonylamino)acetyl]amino]acetamide CAS Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-2-[[2-[(4-methylphenyl)sulfonylamino]-1-oxoethyl]amino]acetamide IUPAC Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-2-[[2-[(4-methylphenyl)sulfonylamino]acetyl]amino]acetamide Traditional Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-2-[[2-(tosylamino)acetyl]amino]acetamide Formula: C20H22N4O4S2 MolecularWeight: 446.54308

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)CNC(=O)CNS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)CNC(=O)CNS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H22N4O4S2/c1-3-14-6-9-16-17(10-14)29-20(23-16)24-19(26)11-21-18(25)12-22-30(27,28)15-7-4-13(2)5-8-15/h4-10,22H,3,11-12H2,1-2H3,(H,21,25)(H,23,24,26)