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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)SC(C)C)NC(=O)CSC2=NC3=CC=CC=C3O2)SC(C)C

Isomeric SMILES

CC1=NC(=C(C(=C1)SC(C)C)NC(=O)CSC2=NC3=CC=CC=C3O2)SC(C)C

InChI

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