(1E,3S)-2,6-dimethyl-1-(2-methyl-1,3-thiazol-4-yl)hepta-1,6-diene-3,5-diol

Systemtic Name: (1E,3S)-2,6-dimethyl-1-(2-methyl-1,3-thiazol-4-yl)hepta-1,6-diene-3,5-diol Openeye Name: (1E,3S)-2,6-dimethyl-1-(2-methylthiazol-4-yl)hepta-1,6-diene-3,5-diol CAS Name: (1E,3S)-2,6-dimethyl-1-(2-methyl-4-thiazolyl)hepta-1,6-diene-3,5-diol IUPAC Name: (1E,3S)-2,6-dimethyl-1-(2-methyl-1,3-thiazol-4-yl)hepta-1,6-diene-3,5-diol Traditional Name: (1E,3S)-2,6-dimethyl-1-(2-methylthiazol-4-yl)hepta-1,6-diene-3,5-diol Formula: C13H19NO2S MolecularWeight: 253.36046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C=C(C)C(CC(C(=C)C)O)O

Isomeric SMILES

CC1=NC(=CS1)/C=C(\C)/[C@H](CC(C(=C)C)O)O

InChI

InChI=1S/C13H19NO2S/c1-8(2)12(15)6-13(16)9(3)5-11-7-17-10(4)14-11/h5,7,12-13,15-16H,1,6H2,2-4H3/b9-5+/t12?,13-/m0/s1