9-(1,3-benzothiazol-2-ylsulfanyl)-N-[2,6-di(propan-2-yl)phenyl]nonanamide

Systemtic Name: 9-(1,3-benzothiazol-2-ylsulfanyl)-N-[2,6-di(propan-2-yl)phenyl]nonanamide Openeye Name: 9-(1,3-benzothiazol-2-ylsulfanyl)-N-(2,6-diisopropylphenyl)nonanamide CAS Name: 9-(1,3-benzothiazol-2-ylthio)-N-[2,6-di(propan-2-yl)phenyl]nonanamide IUPAC Name: 9-(1,3-benzothiazol-2-ylsulfanyl)-N-[2,6-di(propan-2-yl)phenyl]nonanamide Traditional Name: 9-(1,3-benzothiazol-2-ylthio)-N-(2,6-diisopropylphenyl)pelargonamide Formula: C28H38N2OS2 MolecularWeight: 482.74412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)CCCCCCCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)CCCCCCCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C28H38N2OS2/c1-20(2)22-14-13-15-23(21(3)4)27(22)30-26(31)18-9-7-5-6-8-12-19-32-28-29-24-16-10-11-17-25(24)33-28/h10-11,13-17,20-21H,5-9,12,18-19H2,1-4H3,(H,30,31)