1-(2-decylsulfanyl-3-hexoxy-propyl)imidazole; ethanedioic acid

Systemtic Name: 1-(2-decylsulfanyl-3-hexoxy-propyl)imidazole; ethanedioic acid Openeye Name: 1-(2-decylsulfanyl-3-hexoxy-propyl)imidazole; oxalic acid CAS Name: 1-[2-(decylthio)-3-hexoxypropyl]imidazole; oxalic acid IUPAC Name: 1-(2-decylsulfanyl-3-hexoxypropyl)imidazole; oxalic acid Traditional Name: 1-[2-(decylthio)-3-hexoxy-propyl]imidazole; oxalic acid Formula: C24H44N2O5S MolecularWeight: 472.68156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSC(CN1C=CN=C1)COCCCCCC.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCCCCCCCSC(CN1C=CN=C1)COCCCCCC.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H42N2OS.C2H2O4/c1-3-5-7-9-10-11-12-14-18-26-22(19-24-16-15-23-21-24)20-25-17-13-8-6-4-2;3-1(4)2(5)6/h15-16,21-22H,3-14,17-20H2,1-2H3;(H,3,4)(H,5,6)