3-[1,2-bis(4-hydroxyphenyl)ethylsulfanyl]-N-butyl-N-methyl-propanamide

Systemtic Name: 3-[1,2-bis(4-hydroxyphenyl)ethylsulfanyl]-N-butyl-N-methyl-propanamide Openeye Name: 3-[1,2-bis(4-hydroxyphenyl)ethylsulfanyl]-N-butyl-N-methyl-propanamide CAS Name: 3-[1,2-bis(4-hydroxyphenyl)ethylthio]-N-butyl-N-methylpropanamide IUPAC Name: 3-[1,2-bis(4-hydroxyphenyl)ethylsulfanyl]-N-butyl-N-methylpropanamide Traditional Name: 3-[1,2-bis(4-hydroxyphenyl)ethylthio]-N-butyl-N-methyl-propionamide Formula: C22H29NO3S MolecularWeight: 387.53556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)CCSC(CC1=CC=C(C=C1)O)C2=CC=C(C=C2)O

Isomeric SMILES

CCCCN(C)C(=O)CCSC(CC1=CC=C(C=C1)O)C2=CC=C(C=C2)O

InChI

InChI=1S/C22H29NO3S/c1-3-4-14-23(2)22(26)13-15-27-21(18-7-11-20(25)12-8-18)16-17-5-9-19(24)10-6-17/h5-12,21,24-25H,3-4,13-16H2,1-2H3