4-methylsulfanyl-N-(2-methylsulfanylethyl)-3-[(4-octylsulfanylphenyl)carbonylamino]benzamide

Systemtic Name: 4-methylsulfanyl-N-(2-methylsulfanylethyl)-3-[(4-octylsulfanylphenyl)carbonylamino]benzamide Openeye Name: 4-methylsulfanyl-N-(2-methylsulfanylethyl)-3-[(4-octylsulfanylbenzoyl)amino]benzamide CAS Name: 4-(methylthio)-N-[2-(methylthio)ethyl]-3-[[[4-(octylthio)phenyl]-oxomethyl]amino]benzamide IUPAC Name: 4-methylsulfanyl-N-(2-methylsulfanylethyl)-3-[(4-octylsulfanylbenzoyl)amino]benzamide Traditional Name: 4-(methylthio)-N-[2-(methylthio)ethyl]-3-[[4-(octylthio)benzoyl]amino]benzamide Formula: C26H36N2O2S3 MolecularWeight: 504.77124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)NCCSC)SC

Isomeric SMILES

CCCCCCCCSC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)NCCSC)SC

InChI

InChI=1S/C26H36N2O2S3/c1-4-5-6-7-8-9-17-33-22-13-10-20(11-14-22)26(30)28-23-19-21(12-15-24(23)32-3)25(29)27-16-18-31-2/h10-15,19H,4-9,16-18H2,1-3H3,(H,27,29)(H,28,30)