9-(1,3-benzothiazol-2-ylsulfanyl)-N-[2,4-bis(ethylsulfanyl)-6-methyl-pyridin-3-yl]nonanamide

Systemtic Name: 9-(1,3-benzothiazol-2-ylsulfanyl)-N-[2,4-bis(ethylsulfanyl)-6-methyl-pyridin-3-yl]nonanamide Openeye Name: 9-(1,3-benzothiazol-2-ylsulfanyl)-N-[2,4-bis(ethylsulfanyl)-6-methyl-3-pyridyl]nonanamide CAS Name: 9-(1,3-benzothiazol-2-ylthio)-N-[2,4-bis(ethylthio)-6-methyl-3-pyridinyl]nonanamide IUPAC Name: 9-(1,3-benzothiazol-2-ylsulfanyl)-N-[2,4-bis(ethylsulfanyl)-6-methylpyridin-3-yl]nonanamide Traditional Name: 9-(1,3-benzothiazol-2-ylthio)-N-[2,4-bis(ethylthio)-6-methyl-3-pyridyl]pelargonamide Formula: C26H35N3OS4 MolecularWeight: 533.8356

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC(=NC(=C1NC(=O)CCCCCCCCSC2=NC3=CC=CC=C3S2)SCC)C

Isomeric SMILES

CCSC1=CC(=NC(=C1NC(=O)CCCCCCCCSC2=NC3=CC=CC=C3S2)SCC)C

InChI

InChI=1S/C26H35N3OS4/c1-4-31-22-18-19(3)27-25(32-5-2)24(22)29-23(30)16-10-8-6-7-9-13-17-33-26-28-20-14-11-12-15-21(20)34-26/h11-12,14-15,18H,4-10,13,16-17H2,1-3H3,(H,29,30)