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

Systemtic Name: 6-(1,3-benzoxazol-2-ylsulfanyl)-N-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]hexanamide Openeye Name: 6-(1,3-benzoxazol-2-ylsulfanyl)-N-[6-methyl-2,4-bis(methylsulfanyl)-3-pyridyl]hexanamide CAS Name: 6-(1,3-benzoxazol-2-ylthio)-N-[6-methyl-2,4-bis(methylthio)-3-pyridinyl]hexanamide IUPAC Name: 6-(1,3-benzoxazol-2-ylsulfanyl)-N-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]hexanamide Traditional Name: 6-(1,3-benzoxazol-2-ylthio)-N-[6-methyl-2,4-bis(methylthio)-3-pyridyl]hexanamide Formula: C21H25N3O2S3 MolecularWeight: 447.6371

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)SC)NC(=O)CCCCCSC2=NC3=CC=CC=C3O2)SC

Isomeric SMILES

CC1=NC(=C(C(=C1)SC)NC(=O)CCCCCSC2=NC3=CC=CC=C3O2)SC

InChI

InChI=1S/C21H25N3O2S3/c1-14-13-17(27-2)19(20(22-14)28-3)24-18(25)11-5-4-8-12-29-21-23-15-9-6-7-10-16(15)26-21/h6-7,9-10,13H,4-5,8,11-12H2,1-3H3,(H,24,25)