8-[(5-chloranyl-4-methyl-7-propan-2-yl-1,3-benzoxazol-2-yl)sulfanyl]-N-[6-methyl-2,4-bis(propan-2-ylsulfanyl)pyridin-3-yl]octanamide

Systemtic Name: 8-[(5-chloranyl-4-methyl-7-propan-2-yl-1,3-benzoxazol-2-yl)sulfanyl]-N-[6-methyl-2,4-bis(propan-2-ylsulfanyl)pyridin-3-yl]octanamide Openeye Name: N-[2,4-bis(isopropylsulfanyl)-6-methyl-3-pyridyl]-8-[(5-chloro-7-isopropyl-4-methyl-1,3-benzoxazol-2-yl)sulfanyl]octanamide CAS Name: 8-[(5-chloro-4-methyl-7-propan-2-yl-1,3-benzoxazol-2-yl)thio]-N-[6-methyl-2,4-bis(propan-2-ylthio)-3-pyridinyl]octanamide IUPAC Name: 8-[(5-chloro-4-methyl-7-propan-2-yl-1,3-benzoxazol-2-yl)sulfanyl]-N-[6-methyl-2,4-bis(propan-2-ylsulfanyl)pyridin-3-yl]octanamide Traditional Name: N-[2,4-bis(isopropylthio)-6-methyl-3-pyridyl]-8-[(5-chloro-7-isopropyl-4-methyl-1,3-benzoxazol-2-yl)thio]caprylamide Formula: C31H44ClN3O2S3 MolecularWeight: 622.34796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)SC(C)C)NC(=O)CCCCCCCSC2=NC3=C(O2)C(=CC(=C3C)Cl)C(C)C)SC(C)C

Isomeric SMILES

CC1=NC(=C(C(=C1)SC(C)C)NC(=O)CCCCCCCSC2=NC3=C(O2)C(=CC(=C3C)Cl)C(C)C)SC(C)C

InChI

InChI=1S/C31H44ClN3O2S3/c1-18(2)23-17-24(32)22(8)27-29(23)37-31(35-27)38-15-13-11-9-10-12-14-26(36)34-28-25(39-19(3)4)16-21(7)33-30(28)40-20(5)6/h16-20H,9-15H2,1-8H3,(H,34,36)