[2-[ethanoyl-(4-ethylphenyl)amino]-1,3-thiazol-4-yl]methyl (E)-3-thiophen-2-ylprop-2-enoate

Systemtic Name: [2-[ethanoyl-(4-ethylphenyl)amino]-1,3-thiazol-4-yl]methyl (E)-3-thiophen-2-ylprop-2-enoate Openeye Name: [2-(N-acetyl-4-ethyl-anilino)thiazol-4-yl]methyl (E)-3-(2-thienyl)prop-2-enoate CAS Name: (E)-3-thiophen-2-yl-2-propenoic acid [2-(N-acetyl-4-ethylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-4-ethylanilino)-1,3-thiazol-4-yl]methyl (E)-3-thiophen-2-ylprop-2-enoate Traditional Name: (E)-3-(2-thienyl)acrylic acid [2-(N-acetyl-4-ethyl-anilino)thiazol-4-yl]methyl ester Formula: C21H20N2O3S2 MolecularWeight: 412.5251

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(C2=NC(=CS2)COC(=O)C=CC3=CC=CS3)C(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)N(C2=NC(=CS2)COC(=O)/C=C/C3=CC=CS3)C(=O)C

InChI

InChI=1S/C21H20N2O3S2/c1-3-16-6-8-18(9-7-16)23(15(2)24)21-22-17(14-28-21)13-26-20(25)11-10-19-5-4-12-27-19/h4-12,14H,3,13H2,1-2H3/b11-10+