(2,5-dimethylphenyl)methyl 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate

Systemtic Name: (2,5-dimethylphenyl)methyl 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Openeye Name: (2,5-dimethylphenyl)methyl 2-(allylamino)thiazole-4-carboxylate CAS Name: 2-(prop-2-enylamino)-4-thiazolecarboxylic acid (2,5-dimethylphenyl)methyl ester IUPAC Name: (2,5-dimethylphenyl)methyl 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(allylamino)thiazole-4-carboxylic acid (2,5-dimethylbenzyl) ester Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)COC(=O)C2=CSC(=N2)NCC=C

Isomeric SMILES

CC1=CC(=C(C=C1)C)COC(=O)C2=CSC(=N2)NCC=C

InChI

InChI=1S/C16H18N2O2S/c1-4-7-17-16-18-14(10-21-16)15(19)20-9-13-8-11(2)5-6-12(13)3/h4-6,8,10H,1,7,9H2,2-3H3,(H,17,18)