N-[4-[[1-[(4-acetamidophenyl)methylsulfanyl]-2-imidazol-1-yl-ethyl]sulfanylmethyl]phenyl]ethanamide

Systemtic Name: N-[4-[[1-[(4-acetamidophenyl)methylsulfanyl]-2-imidazol-1-yl-ethyl]sulfanylmethyl]phenyl]ethanamide Openeye Name: N-[4-[[1-[(4-acetamidophenyl)methylsulfanyl]-2-imidazol-1-yl-ethyl]sulfanylmethyl]phenyl]acetamide CAS Name: N-[4-[[[1-[(4-acetamidophenyl)methylthio]-2-(1-imidazolyl)ethyl]thio]methyl]phenyl]acetamide IUPAC Name: N-[4-[[1-[(4-acetamidophenyl)methylsulfanyl]-2-imidazol-1-ylethyl]sulfanylmethyl]phenyl]acetamide Traditional Name: N-[4-[[[1-[(4-acetamidobenzyl)thio]-2-imidazol-1-yl-ethyl]thio]methyl]phenyl]acetamide Formula: C23H26N4O2S2 MolecularWeight: 454.60814

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CSC(CN2C=CN=C2)SCC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CSC(CN2C=CN=C2)SCC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C23H26N4O2S2/c1-17(28)25-21-7-3-19(4-8-21)14-30-23(13-27-12-11-24-16-27)31-15-20-5-9-22(10-6-20)26-18(2)29/h3-12,16,23H,13-15H2,1-2H3,(H,25,28)(H,26,29)