N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(2-phenacylsulfanyl-1,3-thiazol-4-yl)ethanamide

Systemtic Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(2-phenacylsulfanyl-1,3-thiazol-4-yl)ethanamide Openeye Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(2-phenacylsulfanylthiazol-4-yl)acetamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-[2-(phenacylthio)-4-thiazolyl]acetamide IUPAC Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(2-phenacylsulfanyl-1,3-thiazol-4-yl)acetamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-2-[2-(phenacylthio)thiazol-4-yl]acetamide Formula: C21H17N3O4S4 MolecularWeight: 503.63738

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CC3=CSC(=N3)SCC(=O)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CC3=CSC(=N3)SCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H17N3O4S4/c1-32(27,28)15-7-8-16-18(10-15)31-20(23-16)24-19(26)9-14-11-29-21(22-14)30-12-17(25)13-5-3-2-4-6-13/h2-8,10-11H,9,12H2,1H3,(H,23,24,26)