N-(2-tert-butylsulfanylethyl)-2-(2,3,4,5,6-pentamethylphenyl)carbonyl-benzamide

Systemtic Name: N-(2-tert-butylsulfanylethyl)-2-(2,3,4,5,6-pentamethylphenyl)carbonyl-benzamide Openeye Name: N-(2-tert-butylsulfanylethyl)-2-(2,3,4,5,6-pentamethylbenzoyl)benzamide CAS Name: N-[2-(tert-butylthio)ethyl]-2-[oxo-(2,3,4,5,6-pentamethylphenyl)methyl]benzamide IUPAC Name: N-(2-tert-butylsulfanylethyl)-2-(2,3,4,5,6-pentamethylbenzoyl)benzamide Traditional Name: N-[2-(tert-butylthio)ethyl]-2-(2,3,4,5,6-pentamethylbenzoyl)benzamide Formula: C25H33NO2S MolecularWeight: 411.60002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)C(=O)C2=CC=CC=C2C(=O)NCCSC(C)(C)C)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)C(=O)C2=CC=CC=C2C(=O)NCCSC(C)(C)C)C)C

InChI

InChI=1S/C25H33NO2S/c1-15-16(2)18(4)22(19(5)17(15)3)23(27)20-11-9-10-12-21(20)24(28)26-13-14-29-25(6,7)8/h9-12H,13-14H2,1-8H3,(H,26,28)