N-(2-octadecan-2-ylsulfanylethylcarbamoyl)-4-(4-oxidanylphenoxy)benzamide

Systemtic Name: N-(2-octadecan-2-ylsulfanylethylcarbamoyl)-4-(4-oxidanylphenoxy)benzamide Openeye Name: 4-(4-hydroxyphenoxy)-N-[2-(1-methylheptadecylsulfanyl)ethylcarbamoyl]benzamide CAS Name: 4-(4-hydroxyphenoxy)-N-[[2-(octadecan-2-ylthio)ethylamino]-oxomethyl]benzamide IUPAC Name: 4-(4-hydroxyphenoxy)-N-(2-octadecan-2-ylsulfanylethylcarbamoyl)benzamide Traditional Name: 4-(4-hydroxyphenoxy)-N-[2-(1-methylheptadecylthio)ethylcarbamoyl]benzamide Formula: C34H52N2O4S MolecularWeight: 584.85268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C)SCCNC(=O)NC(=O)C1=CC=C(C=C1)OC2=CC=C(C=C2)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C)SCCNC(=O)NC(=O)C1=CC=C(C=C1)OC2=CC=C(C=C2)O

InChI

InChI=1S/C34H52N2O4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-28(2)41-27-26-35-34(39)36-33(38)29-18-22-31(23-19-29)40-32-24-20-30(37)21-25-32/h18-25,28,37H,3-17,26-27H2,1-2H3,(H2,35,36,38,39)