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

Systemtic Name: [2-[ethanoyl-(4-ethylphenyl)amino]-1,3-thiazol-4-yl]methyl (E)-3-thiophen-3-ylprop-2-enoate Openeye Name: [2-(N-acetyl-4-ethyl-anilino)thiazol-4-yl]methyl (E)-3-(3-thienyl)prop-2-enoate CAS Name: (E)-3-(3-thiophenyl)-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-3-ylprop-2-enoate Traditional Name: (E)-3-(3-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=CSC=C3)C(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O3S2/c1-3-16-4-7-19(8-5-16)23(15(2)24)21-22-18(14-28-21)12-26-20(25)9-6-17-10-11-27-13-17/h4-11,13-14H,3,12H2,1-2H3/b9-6+