2-[2-[3-methyl-5-[(E)-5-methyl-3-oxidanyl-non-1-enyl]-2-oxidanylidene-imidazolidin-1-yl]ethylsulfanyl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[2-[3-methyl-5-[(E)-5-methyl-3-oxidanyl-non-1-enyl]-2-oxidanylidene-imidazolidin-1-yl]ethylsulfanyl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[2-[5-[(E)-3-hydroxy-5-methyl-non-1-enyl]-3-methyl-2-oxo-imidazolidin-1-yl]ethylsulfanyl]thiazole-4-carboxylic acid CAS Name: 2-[2-[5-[(E)-3-hydroxy-5-methylnon-1-enyl]-3-methyl-2-oxo-1-imidazolidinyl]ethylthio]-4-thiazolecarboxylic acid IUPAC Name: 2-[2-[5-[(E)-3-hydroxy-5-methylnon-1-enyl]-3-methyl-2-oxoimidazolidin-1-yl]ethylsulfanyl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[2-[5-[(E)-3-hydroxy-5-methyl-non-1-enyl]-2-keto-3-methyl-imidazolidin-1-yl]ethylthio]thiazole-4-carboxylic acid Formula: C20H31N3O4S2 MolecularWeight: 441.60784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)CC(C=CC1CN(C(=O)N1CCSC2=NC(=CS2)C(=O)O)C)O

Isomeric SMILES

CCCCC(C)CC(/C=C/C1CN(C(=O)N1CCSC2=NC(=CS2)C(=O)O)C)O

InChI

InChI=1S/C20H31N3O4S2/c1-4-5-6-14(2)11-16(24)8-7-15-12-22(3)20(27)23(15)9-10-28-19-21-17(13-29-19)18(25)26/h7-8,13-16,24H,4-6,9-12H2,1-3H3,(H,25,26)/b8-7+