6-(1,3-benzoxazol-2-ylsulfanyl)-N-[2,4-bis(ethylsulfanyl)-6-methyl-pyridin-3-yl]hexanamide

Systemtic Name: 6-(1,3-benzoxazol-2-ylsulfanyl)-N-[2,4-bis(ethylsulfanyl)-6-methyl-pyridin-3-yl]hexanamide Openeye Name: 6-(1,3-benzoxazol-2-ylsulfanyl)-N-[2,4-bis(ethylsulfanyl)-6-methyl-3-pyridyl]hexanamide CAS Name: 6-(1,3-benzoxazol-2-ylthio)-N-[2,4-bis(ethylthio)-6-methyl-3-pyridinyl]hexanamide IUPAC Name: 6-(1,3-benzoxazol-2-ylsulfanyl)-N-[2,4-bis(ethylsulfanyl)-6-methylpyridin-3-yl]hexanamide Traditional Name: 6-(1,3-benzoxazol-2-ylthio)-N-[2,4-bis(ethylthio)-6-methyl-3-pyridyl]hexanamide Formula: C23H29N3O2S3 MolecularWeight: 475.69026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC(=NC(=C1NC(=O)CCCCCSC2=NC3=CC=CC=C3O2)SCC)C

Isomeric SMILES

CCSC1=CC(=NC(=C1NC(=O)CCCCCSC2=NC3=CC=CC=C3O2)SCC)C

InChI

InChI=1S/C23H29N3O2S3/c1-4-29-19-15-16(3)24-22(30-5-2)21(19)26-20(27)13-7-6-10-14-31-23-25-17-11-8-9-12-18(17)28-23/h8-9,11-12,15H,4-7,10,13-14H2,1-3H3,(H,26,27)