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

Systemtic Name: [2-[ethanoyl-(2-ethylphenyl)amino]-1,3-thiazol-4-yl]methyl 4-aminocarbonylbenzoate Openeye Name: [2-(N-acetyl-2-ethyl-anilino)thiazol-4-yl]methyl 4-carbamoylbenzoate CAS Name: 4-carbamoylbenzoic acid [2-(N-acetyl-2-ethylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-2-ethylanilino)-1,3-thiazol-4-yl]methyl 4-carbamoylbenzoate Traditional Name: 4-carbamoylbenzoic acid [2-(N-acetyl-2-ethyl-anilino)thiazol-4-yl]methyl ester Formula: C22H21N3O4S MolecularWeight: 423.48484

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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(=O)N)C(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C22H21N3O4S/c1-3-15-6-4-5-7-19(15)25(14(2)26)22-24-18(13-30-22)12-29-21(28)17-10-8-16(9-11-17)20(23)27/h4-11,13H,3,12H2,1-2H3,(H2,23,27)