N-[3-(4-tert-butylphenyl)carbonylphenyl]-2-[(4-nitrophenyl)methylsulfanyl]ethanamide

Systemtic Name: N-[3-(4-tert-butylphenyl)carbonylphenyl]-2-[(4-nitrophenyl)methylsulfanyl]ethanamide Openeye Name: N-[3-(4-tert-butylbenzoyl)phenyl]-2-[(4-nitrophenyl)methylsulfanyl]acetamide CAS Name: N-[3-[(4-tert-butylphenyl)-oxomethyl]phenyl]-2-[(4-nitrophenyl)methylthio]acetamide IUPAC Name: N-[3-(4-tert-butylbenzoyl)phenyl]-2-[(4-nitrophenyl)methylsulfanyl]acetamide Traditional Name: N-[3-(4-tert-butylbenzoyl)phenyl]-2-[(4-nitrobenzyl)thio]acetamide Formula: C26H26N2O4S MolecularWeight: 462.56064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)NC(=O)CSCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)NC(=O)CSCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C26H26N2O4S/c1-26(2,3)21-11-9-19(10-12-21)25(30)20-5-4-6-22(15-20)27-24(29)17-33-16-18-7-13-23(14-8-18)28(31)32/h4-15H,16-17H2,1-3H3,(H,27,29)