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

Systemtic Name: 6-(1,3-benzothiazol-2-ylsulfanyl)-N-[2,6-di(propan-2-yl)phenyl]hexanamide Openeye Name: 6-(1,3-benzothiazol-2-ylsulfanyl)-N-(2,6-diisopropylphenyl)hexanamide CAS Name: 6-(1,3-benzothiazol-2-ylthio)-N-[2,6-di(propan-2-yl)phenyl]hexanamide IUPAC Name: 6-(1,3-benzothiazol-2-ylsulfanyl)-N-[2,6-di(propan-2-yl)phenyl]hexanamide Traditional Name: 6-(1,3-benzothiazol-2-ylthio)-N-(2,6-diisopropylphenyl)hexanamide Formula: C25H32N2OS2 MolecularWeight: 440.66438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)CCCCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)CCCCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C25H32N2OS2/c1-17(2)19-11-10-12-20(18(3)4)24(19)27-23(28)15-6-5-9-16-29-25-26-21-13-7-8-14-22(21)30-25/h7-8,10-14,17-18H,5-6,9,15-16H2,1-4H3,(H,27,28)