2-(5-tert-butyl-2-methyl-phenyl)sulfanyl-N-[4-(pyridin-4-ylmethyl)phenyl]ethanamide

Systemtic Name: 2-(5-tert-butyl-2-methyl-phenyl)sulfanyl-N-[4-(pyridin-4-ylmethyl)phenyl]ethanamide Openeye Name: 2-(5-tert-butyl-2-methyl-phenyl)sulfanyl-N-[4-(4-pyridylmethyl)phenyl]acetamide CAS Name: 2-[(5-tert-butyl-2-methylphenyl)thio]-N-[4-(pyridin-4-ylmethyl)phenyl]acetamide IUPAC Name: 2-(5-tert-butyl-2-methylphenyl)sulfanyl-N-[4-(pyridin-4-ylmethyl)phenyl]acetamide Traditional Name: 2-[(5-tert-butyl-2-methyl-phenyl)thio]-N-[4-(4-pyridylmethyl)phenyl]acetamide Formula: C25H28N2OS MolecularWeight: 404.56762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C)C)SCC(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)SCC(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3

InChI

InChI=1S/C25H28N2OS/c1-18-5-8-21(25(2,3)4)16-23(18)29-17-24(28)27-22-9-6-19(7-10-22)15-20-11-13-26-14-12-20/h5-14,16H,15,17H2,1-4H3,(H,27,28)