[(1E,3S,5Z)-6-iodanyl-2-methyl-1-(2-methyl-1,3-thiazol-4-yl)hexa-1,5-dien-3-yl] ethanoate

Systemtic Name: [(1E,3S,5Z)-6-iodanyl-2-methyl-1-(2-methyl-1,3-thiazol-4-yl)hexa-1,5-dien-3-yl] ethanoate Openeye Name: [(Z,1S)-4-iodo-1-[(E)-1-methyl-2-(2-methylthiazol-4-yl)vinyl]but-3-enyl] acetate CAS Name: acetic acid [(1E,3S,5Z)-6-iodo-2-methyl-1-(2-methyl-4-thiazolyl)hexa-1,5-dien-3-yl] ester IUPAC Name: [(1E,3S,5Z)-6-iodo-2-methyl-1-(2-methyl-1,3-thiazol-4-yl)hexa-1,5-dien-3-yl] acetate Traditional Name: acetic acid [(Z,1S)-4-iodo-1-[(E)-1-methyl-2-(2-methylthiazol-4-yl)vinyl]but-3-enyl] ester Formula: C13H16INO2S MolecularWeight: 377.24111

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16INO2S/c1-9(7-12-8-18-10(2)15-12)13(5-4-6-14)17-11(3)16/h4,6-8,13H,5H2,1-3H3/b6-4-,9-7+/t13-/m0/s1