[2-[(2,6-dimethylphenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]methyl 1H-pyrrole-2-carboxylate

Systemtic Name: [2-[(2,6-dimethylphenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]methyl 1H-pyrrole-2-carboxylate Openeye Name: [2-(N-acetyl-2,6-dimethyl-anilino)thiazol-4-yl]methyl 1H-pyrrole-2-carboxylate CAS Name: 1H-pyrrole-2-carboxylic acid [2-(N-acetyl-2,6-dimethylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-2,6-dimethylanilino)-1,3-thiazol-4-yl]methyl 1H-pyrrole-2-carboxylate Traditional Name: 1H-pyrrole-2-carboxylic acid [2-(N-acetyl-2,6-dimethyl-anilino)thiazol-4-yl]methyl ester Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N(C2=NC(=CS2)COC(=O)C3=CC=CN3)C(=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)N(C2=NC(=CS2)COC(=O)C3=CC=CN3)C(=O)C

InChI

InChI=1S/C19H19N3O3S/c1-12-6-4-7-13(2)17(12)22(14(3)23)19-21-15(11-26-19)10-25-18(24)16-8-5-9-20-16/h4-9,11,20H,10H2,1-3H3