[2-[4-[(2E)-hexa-2,5-dienyl]-1,3-thiazol-2-yl]-2-methyl-hex-5-en-3-yl] prop-2-ene-1-sulfonate

Systemtic Name: [2-[4-[(2E)-hexa-2,5-dienyl]-1,3-thiazol-2-yl]-2-methyl-hex-5-en-3-yl] prop-2-ene-1-sulfonate Openeye Name: 1-[1-[4-[(2E)-hexa-2,5-dienyl]thiazol-2-yl]-1-methyl-ethyl]but-3-enyl prop-2-ene-1-sulfonate CAS Name: 2-propene-1-sulfonic acid [2-[4-[(2E)-hexa-2,5-dienyl]-2-thiazolyl]-2-methylhex-5-en-3-yl] ester IUPAC Name: [2-[4-[(2E)-hexa-2,5-dienyl]-1,3-thiazol-2-yl]-2-methylhex-5-en-3-yl] prop-2-ene-1-sulfonate Traditional Name: prop-2-ene-1-sulfonic acid 1-[1-[4-[(2E)-hexa-2,5-dienyl]thiazol-2-yl]-1-methyl-ethyl]but-3-enyl ester Formula: C19H27NO3S2 MolecularWeight: 381.55258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=NC(=CS1)CC=CCC=C)C(CC=C)OS(=O)(=O)CC=C

Isomeric SMILES

CC(C)(C1=NC(=CS1)C/C=C/CC=C)C(CC=C)OS(=O)(=O)CC=C

InChI

InChI=1S/C19H27NO3S2/c1-6-9-10-11-13-16-15-24-18(20-16)19(4,5)17(12-7-2)23-25(21,22)14-8-3/h6-8,10-11,15,17H,1-3,9,12-14H2,4-5H3/b11-10+