ethyl 2-[2-[(E)-but-2-enoyl]oxyethanoyl-(phenylmethyl)amino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[2-[(E)-but-2-enoyl]oxyethanoyl-(phenylmethyl)amino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[benzyl-[2-[(E)-but-2-enoyl]oxyacetyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 4-methyl-2-[[1-oxo-2-[(E)-1-oxobut-2-enoxy]ethyl]-(phenylmethyl)amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[benzyl-[2-[(E)-but-2-enoyl]oxyacetyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[benzyl-[2-[(E)-but-2-enoyl]oxyacetyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)N(CC2=CC=CC=C2)C(=O)COC(=O)C=CC)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)N(CC2=CC=CC=C2)C(=O)COC(=O)/C=C/C)C

InChI

InChI=1S/C20H22N2O5S/c1-4-9-17(24)27-13-16(23)22(12-15-10-7-6-8-11-15)20-21-14(3)18(28-20)19(25)26-5-2/h4,6-11H,5,12-13H2,1-3H3/b9-4+