methyl 2-[(E)-1-methoxy-4-oxidanyl-1-oxidanylidene-nonadec-2-en-5-yl]sulfanyl-3,5-dimethyl-imidazole-4-carboxylate

Systemtic Name: methyl 2-[(E)-1-methoxy-4-oxidanyl-1-oxidanylidene-nonadec-2-en-5-yl]sulfanyl-3,5-dimethyl-imidazole-4-carboxylate Openeye Name: methyl 2-[1-[(E)-1-hydroxy-4-methoxy-4-oxo-but-2-enyl]pentadecylsulfanyl]-3,5-dimethyl-imidazole-4-carboxylate CAS Name: 2-[[(E)-4-hydroxy-1-methoxy-1-oxononadec-2-en-5-yl]thio]-3,5-dimethyl-4-imidazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[(E)-4-hydroxy-1-methoxy-1-oxononadec-2-en-5-yl]sulfanyl-3,5-dimethylimidazole-4-carboxylate Traditional Name: 2-[[(E)-2-hydroxy-5-keto-5-methoxy-1-myristyl-pent-3-enyl]thio]-3,5-dimethyl-imidazole-4-carboxylic acid methyl ester Formula: C27H46N2O5S MolecularWeight: 510.72954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C(C=CC(=O)OC)O)SC1=NC(=C(N1C)C(=O)OC)C

Isomeric SMILES

CCCCCCCCCCCCCCC(C(/C=C/C(=O)OC)O)SC1=NC(=C(N1C)C(=O)OC)C

InChI

InChI=1S/C27H46N2O5S/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-23(22(30)19-20-24(31)33-4)35-27-28-21(2)25(29(27)3)26(32)34-5/h19-20,22-23,30H,6-18H2,1-5H3/b20-19+