[(1E,3S)-2-methyl-1-(2-methyl-1,3-thiazol-5-yl)hexa-1,5-dien-3-yl] ethanoate

Systemtic Name: [(1E,3S)-2-methyl-1-(2-methyl-1,3-thiazol-5-yl)hexa-1,5-dien-3-yl] ethanoate Openeye Name: [(1S)-1-[(E)-1-methyl-2-(2-methylthiazol-5-yl)vinyl]but-3-enyl] acetate CAS Name: acetic acid [(1E,3S)-2-methyl-1-(2-methyl-5-thiazolyl)hexa-1,5-dien-3-yl] ester IUPAC Name: [(1E,3S)-2-methyl-1-(2-methyl-1,3-thiazol-5-yl)hexa-1,5-dien-3-yl] acetate Traditional Name: acetic acid [(1S)-1-[(E)-1-methyl-2-(2-methylthiazol-5-yl)vinyl]but-3-enyl] ester Formula: C13H17NO2S MolecularWeight: 251.34458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(S1)C=C(C)C(CC=C)OC(=O)C

Isomeric SMILES

CC1=NC=C(S1)/C=C(\C)/[C@H](CC=C)OC(=O)C

InChI

InChI=1S/C13H17NO2S/c1-5-6-13(16-11(4)15)9(2)7-12-8-14-10(3)17-12/h5,7-8,13H,1,6H2,2-4H3/b9-7+/t13-/m0/s1