9-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-methylsulfanylpyridin-3-yl)nonanamide

Systemtic Name: 9-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-methylsulfanylpyridin-3-yl)nonanamide Openeye Name: 9-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-methylsulfanyl-3-pyridyl)nonanamide CAS Name: 9-(1,3-benzothiazol-2-ylthio)-N-[2-(methylthio)-3-pyridinyl]nonanamide IUPAC Name: 9-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-methylsulfanylpyridin-3-yl)nonanamide Traditional Name: 9-(1,3-benzothiazol-2-ylthio)-N-[2-(methylthio)-3-pyridyl]pelargonamide Formula: C22H27N3OS3 MolecularWeight: 445.66428

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)NC(=O)CCCCCCCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CSC1=C(C=CC=N1)NC(=O)CCCCCCCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C22H27N3OS3/c1-27-21-18(12-10-15-23-21)24-20(26)14-6-4-2-3-5-9-16-28-22-25-17-11-7-8-13-19(17)29-22/h7-8,10-13,15H,2-6,9,14,16H2,1H3,(H,24,26)