N-butyl-11-[2-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]sulfanyl-N-methyl-undecanamide

Systemtic Name: N-butyl-11-[2-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]sulfanyl-N-methyl-undecanamide Openeye Name: N-butyl-11-[2-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]sulfanyl-N-methyl-undecanamide CAS Name: N-butyl-11-[[2-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]thio]-N-methylundecanamide IUPAC Name: N-butyl-11-[2-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]sulfanyl-N-methylundecanamide Traditional Name: N-butyl-11-[[2-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]thio]-N-methyl-undecanamide Formula: C31H47NO3S MolecularWeight: 513.77478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)CCCCCCCCCCSC(CC1=CC=C(C=C1)O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCCN(C)C(=O)CCCCCCCCCCSC(CC1=CC=C(C=C1)O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C31H47NO3S/c1-4-5-23-32(2)31(34)14-12-10-8-6-7-9-11-13-24-36-30(25-26-15-19-28(33)20-16-26)27-17-21-29(35-3)22-18-27/h15-22,30,33H,4-14,23-25H2,1-3H3