[(1E)-2-methyl-1-(2-methyl-1,3-thiazol-4-yl)hexa-1,5-dien-3-yl] tridec-12-enoate

Systemtic Name: [(1E)-2-methyl-1-(2-methyl-1,3-thiazol-4-yl)hexa-1,5-dien-3-yl] tridec-12-enoate Openeye Name: 1-[(E)-1-methyl-2-(2-methylthiazol-4-yl)vinyl]but-3-enyl tridec-12-enoate CAS Name: 12-tridecenoic acid [(1E)-2-methyl-1-(2-methyl-4-thiazolyl)hexa-1,5-dien-3-yl] ester IUPAC Name: [(1E)-2-methyl-1-(2-methyl-1,3-thiazol-4-yl)hexa-1,5-dien-3-yl] tridec-12-enoate Traditional Name: tridec-12-enoic acid 1-[(E)-1-methyl-2-(2-methylthiazol-4-yl)vinyl]but-3-enyl ester Formula: C24H37NO2S MolecularWeight: 403.62108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=NC(=CS1)/C=C(\C)/C(CC=C)OC(=O)CCCCCCCCCCC=C

InChI

InChI=1S/C24H37NO2S/c1-5-7-8-9-10-11-12-13-14-15-17-24(26)27-23(16-6-2)20(3)18-22-19-28-21(4)25-22/h5-6,18-19,23H,1-2,7-17H2,3-4H3/b20-18+