5-(1,3-benzothiazol-2-ylsulfanyl)-N-[2,6-di(propan-2-yl)phenyl]-2,2-dimethyl-pentanamide

Systemtic Name: 5-(1,3-benzothiazol-2-ylsulfanyl)-N-[2,6-di(propan-2-yl)phenyl]-2,2-dimethyl-pentanamide Openeye Name: 5-(1,3-benzothiazol-2-ylsulfanyl)-N-(2,6-diisopropylphenyl)-2,2-dimethyl-pentanamide CAS Name: 5-(1,3-benzothiazol-2-ylthio)-N-[2,6-di(propan-2-yl)phenyl]-2,2-dimethylpentanamide IUPAC Name: 5-(1,3-benzothiazol-2-ylsulfanyl)-N-[2,6-di(propan-2-yl)phenyl]-2,2-dimethylpentanamide Traditional Name: 5-(1,3-benzothiazol-2-ylthio)-N-(2,6-diisopropylphenyl)-2,2-dimethyl-valeramide Formula: C26H34N2OS2 MolecularWeight: 454.69096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)C(C)(C)CCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)C(C)(C)CCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C26H34N2OS2/c1-17(2)19-11-9-12-20(18(3)4)23(19)28-24(29)26(5,6)15-10-16-30-25-27-21-13-7-8-14-22(21)31-25/h7-9,11-14,17-18H,10,15-16H2,1-6H3,(H,28,29)