4-[[4-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-5-methyl-1,3-thiazol-2-yl]amino]benzoate

Systemtic Name: 4-[[4-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-5-methyl-1,3-thiazol-2-yl]amino]benzoate Openeye Name: 4-[[4-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-5-methyl-thiazol-2-yl]amino]benzoate CAS Name: 4-[[4-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-5-methyl-2-thiazolyl]amino]benzoate IUPAC Name: 4-[[4-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-5-methyl-1,3-thiazol-2-yl]amino]benzoate Traditional Name: 4-[[4-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-5-methyl-thiazol-2-yl]amino]benzoate Formula: C19H18N3O3S- MolecularWeight: 368.42952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C2=C(SC(=N2)NC3=CC=C(C=C3)C(=O)[O-])C

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C2=C(SC(=N2)NC3=CC=C(C=C3)C(=O)[O-])C

InChI

InChI=1S/C19H19N3O3S/c1-9-15(11(3)23)10(2)20-16(9)17-12(4)26-19(22-17)21-14-7-5-13(6-8-14)18(24)25/h5-8,20H,1-4H3,(H,21,22)(H,24,25)/p-1