N-butyl-6-[2-(4-hydroxyphenyl)-6-oxidanyl-1-benzothiophen-3-yl]-N-methyl-hexanamide

Systemtic Name: N-butyl-6-[2-(4-hydroxyphenyl)-6-oxidanyl-1-benzothiophen-3-yl]-N-methyl-hexanamide Openeye Name: N-butyl-6-[6-hydroxy-2-(4-hydroxyphenyl)benzothiophen-3-yl]-N-methyl-hexanamide CAS Name: N-butyl-6-[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-N-methylhexanamide IUPAC Name: N-butyl-6-[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-N-methylhexanamide Traditional Name: N-butyl-6-[6-hydroxy-2-(4-hydroxyphenyl)benzothiophen-3-yl]-N-methyl-hexanamide Formula: C25H31NO3S MolecularWeight: 425.58354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)CCCCCC1=C(SC2=C1C=CC(=C2)O)C3=CC=C(C=C3)O

Isomeric SMILES

CCCCN(C)C(=O)CCCCCC1=C(SC2=C1C=CC(=C2)O)C3=CC=C(C=C3)O

InChI

InChI=1S/C25H31NO3S/c1-3-4-16-26(2)24(29)9-7-5-6-8-22-21-15-14-20(28)17-23(21)30-25(22)18-10-12-19(27)13-11-18/h10-15,17,27-28H,3-9,16H2,1-2H3