ethyl 5-[[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]amino]-3-methyl-1,2-thiazole-4-carboxylate

Systemtic Name: ethyl 5-[[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]amino]-3-methyl-1,2-thiazole-4-carboxylate Openeye Name: ethyl 5-[[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]amino]-3-methyl-isothiazole-4-carboxylate CAS Name: 5-[[(E)-3-(4-ethoxyphenyl)-1-oxoprop-2-enyl]amino]-3-methyl-4-isothiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]amino]-3-methyl-1,2-thiazole-4-carboxylate Traditional Name: 3-methyl-5-[[(E)-3-p-phenetylacryloyl]amino]isothiazole-4-carboxylic acid ethyl ester Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=CC(=O)NC2=C(C(=NS2)C)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/C(=O)NC2=C(C(=NS2)C)C(=O)OCC

InChI

InChI=1S/C18H20N2O4S/c1-4-23-14-9-6-13(7-10-14)8-11-15(21)19-17-16(12(3)20-25-17)18(22)24-5-2/h6-11H,4-5H2,1-3H3,(H,19,21)/b11-8+