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

Systemtic Name: 6-(1,3-benzoxazol-2-ylsulfanyl)-N-[2,6-bis(methylsulfanyl)pyridin-3-yl]hexanamide Openeye Name: 6-(1,3-benzoxazol-2-ylsulfanyl)-N-[2,6-bis(methylsulfanyl)-3-pyridyl]hexanamide CAS Name: 6-(1,3-benzoxazol-2-ylthio)-N-[2,6-bis(methylthio)-3-pyridinyl]hexanamide IUPAC Name: 6-(1,3-benzoxazol-2-ylsulfanyl)-N-[2,6-bis(methylsulfanyl)pyridin-3-yl]hexanamide Traditional Name: 6-(1,3-benzoxazol-2-ylthio)-N-[2,6-bis(methylthio)-3-pyridyl]hexanamide Formula: C20H23N3O2S3 MolecularWeight: 433.61052

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C(C=C1)NC(=O)CCCCCSC2=NC3=CC=CC=C3O2)SC

Isomeric SMILES

CSC1=NC(=C(C=C1)NC(=O)CCCCCSC2=NC3=CC=CC=C3O2)SC

InChI

InChI=1S/C20H23N3O2S3/c1-26-18-12-11-15(19(23-18)27-2)21-17(24)10-4-3-7-13-28-20-22-14-8-5-6-9-16(14)25-20/h5-6,8-9,11-12H,3-4,7,10,13H2,1-2H3,(H,21,24)