2-butyl-2-[[4-(dimethylamino)-2-[(4-methoxyphenyl)methyl]phenyl]sulfanylmethyl]hexanal

Systemtic Name: 2-butyl-2-[[4-(dimethylamino)-2-[(4-methoxyphenyl)methyl]phenyl]sulfanylmethyl]hexanal Openeye Name: 2-butyl-2-[[4-(dimethylamino)-2-[(4-methoxyphenyl)methyl]phenyl]sulfanylmethyl]hexanal CAS Name: 2-butyl-2-[[[4-(dimethylamino)-2-[(4-methoxyphenyl)methyl]phenyl]thio]methyl]hexanal IUPAC Name: 2-butyl-2-[[4-(dimethylamino)-2-[(4-methoxyphenyl)methyl]phenyl]sulfanylmethyl]hexanal Traditional Name: 2-butyl-2-[[[4-(dimethylamino)-2-p-anisyl-phenyl]thio]methyl]hexanal Formula: C27H39NO2S MolecularWeight: 441.66906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)(CSC1=C(C=C(C=C1)N(C)C)CC2=CC=C(C=C2)OC)C=O

Isomeric SMILES

CCCCC(CCCC)(CSC1=C(C=C(C=C1)N(C)C)CC2=CC=C(C=C2)OC)C=O

InChI

InChI=1S/C27H39NO2S/c1-6-8-16-27(20-29,17-9-7-2)21-31-26-15-12-24(28(3)4)19-23(26)18-22-10-13-25(30-5)14-11-22/h10-15,19-20H,6-9,16-18,21H2,1-5H3