2-[4-(3,4-dimethylphenyl)-2-(pyridin-4-ylcarbonylamino)-1,3-thiazol-5-yl]ethanoate

Systemtic Name: 2-[4-(3,4-dimethylphenyl)-2-(pyridin-4-ylcarbonylamino)-1,3-thiazol-5-yl]ethanoate Openeye Name: 2-[4-(3,4-dimethylphenyl)-2-(pyridine-4-carbonylamino)thiazol-5-yl]acetate CAS Name: 2-[4-(3,4-dimethylphenyl)-2-[[oxo(pyridin-4-yl)methyl]amino]-5-thiazolyl]acetate IUPAC Name: 2-[4-(3,4-dimethylphenyl)-2-(pyridine-4-carbonylamino)-1,3-thiazol-5-yl]acetate Traditional Name: 2-[4-(3,4-dimethylphenyl)-2-isonicotinamido-thiazol-5-yl]acetate Formula: C19H16N3O3S- MolecularWeight: 366.41364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(SC(=N2)NC(=O)C3=CC=NC=C3)CC(=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(SC(=N2)NC(=O)C3=CC=NC=C3)CC(=O)[O-])C

InChI

InChI=1S/C19H17N3O3S/c1-11-3-4-14(9-12(11)2)17-15(10-16(23)24)26-19(21-17)22-18(25)13-5-7-20-8-6-13/h3-9H,10H2,1-2H3,(H,23,24)(H,21,22,25)/p-1