[2-[ethanoyl-(2-ethylphenyl)amino]-1,3-thiazol-4-yl]methyl 4-cyanobenzoate

Systemtic Name: [2-[ethanoyl-(2-ethylphenyl)amino]-1,3-thiazol-4-yl]methyl 4-cyanobenzoate Openeye Name: [2-(N-acetyl-2-ethyl-anilino)thiazol-4-yl]methyl 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [2-(N-acetyl-2-ethylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-2-ethylanilino)-1,3-thiazol-4-yl]methyl 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [2-(N-acetyl-2-ethyl-anilino)thiazol-4-yl]methyl ester Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N(C2=NC(=CS2)COC(=O)C3=CC=C(C=C3)C#N)C(=O)C

Isomeric SMILES

CCC1=CC=CC=C1N(C2=NC(=CS2)COC(=O)C3=CC=C(C=C3)C#N)C(=O)C

InChI

InChI=1S/C22H19N3O3S/c1-3-17-6-4-5-7-20(17)25(15(2)26)22-24-19(14-29-22)13-28-21(27)18-10-8-16(12-23)9-11-18/h4-11,14H,3,13H2,1-2H3