6-[5-methyl-3-(3-phenylpropyl)thiophen-2-yl]sulfanylhexanoic acid

Systemtic Name: 6-[5-methyl-3-(3-phenylpropyl)thiophen-2-yl]sulfanylhexanoic acid Openeye Name: 6-[[5-methyl-3-(3-phenylpropyl)-2-thienyl]sulfanyl]hexanoic acid CAS Name: 6-[[5-methyl-3-(3-phenylpropyl)-2-thiophenyl]thio]hexanoic acid IUPAC Name: 6-[5-methyl-3-(3-phenylpropyl)thiophen-2-yl]sulfanylhexanoic acid Traditional Name: 6-[[5-methyl-3-(3-phenylpropyl)-2-thienyl]thio]hexanoic acid Formula: C20H26O2S2 MolecularWeight: 362.54924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)SCCCCCC(=O)O)CCCC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(S1)SCCCCCC(=O)O)CCCC2=CC=CC=C2

InChI

InChI=1S/C20H26O2S2/c1-16-15-18(12-8-11-17-9-4-2-5-10-17)20(24-16)23-14-7-3-6-13-19(21)22/h2,4-5,9-10,15H,3,6-8,11-14H2,1H3,(H,21,22)