N-[(2-hydroxyphenyl)methyl]-4-(4-hydroxyphenyl)sulfanyl-N-methyl-butanamide

Systemtic Name: N-[(2-hydroxyphenyl)methyl]-4-(4-hydroxyphenyl)sulfanyl-N-methyl-butanamide Openeye Name: N-[(2-hydroxyphenyl)methyl]-4-(4-hydroxyphenyl)sulfanyl-N-methyl-butanamide CAS Name: N-[(2-hydroxyphenyl)methyl]-4-[(4-hydroxyphenyl)thio]-N-methylbutanamide IUPAC Name: N-[(2-hydroxyphenyl)methyl]-4-(4-hydroxyphenyl)sulfanyl-N-methylbutanamide Traditional Name: 4-[(4-hydroxyphenyl)thio]-N-methyl-N-salicyl-butyramide Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1O)C(=O)CCCSC2=CC=C(C=C2)O

Isomeric SMILES

CN(CC1=CC=CC=C1O)C(=O)CCCSC2=CC=C(C=C2)O

InChI

InChI=1S/C18H21NO3S/c1-19(13-14-5-2-3-6-17(14)21)18(22)7-4-12-23-16-10-8-15(20)9-11-16/h2-3,5-6,8-11,20-21H,4,7,12-13H2,1H3