butyl 4-[2-[2-[(6-oxidanylidene-1H-pyridin-3-yl)carbonylamino]-1,3-thiazol-4-yl]ethanoylamino]benzoate

Systemtic Name: butyl 4-[2-[2-[(6-oxidanylidene-1H-pyridin-3-yl)carbonylamino]-1,3-thiazol-4-yl]ethanoylamino]benzoate Openeye Name: butyl 4-[[2-[2-[(6-oxo-1H-pyridine-3-carbonyl)amino]thiazol-4-yl]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[2-[[oxo-(6-oxo-1H-pyridin-3-yl)methyl]amino]-4-thiazolyl]ethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[2-[(6-oxo-1H-pyridine-3-carbonyl)amino]-1,3-thiazol-4-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[2-[(6-keto-1H-pyridine-3-carbonyl)amino]thiazol-4-yl]acetyl]amino]benzoic acid butyl ester Formula: C22H22N4O5S MolecularWeight: 454.49888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)NC(=O)C3=CNC(=O)C=C3

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)NC(=O)C3=CNC(=O)C=C3

InChI

InChI=1S/C22H22N4O5S/c1-2-3-10-31-21(30)14-4-7-16(8-5-14)24-19(28)11-17-13-32-22(25-17)26-20(29)15-6-9-18(27)23-12-15/h4-9,12-13H,2-3,10-11H2,1H3,(H,23,27)(H,24,28)(H,25,26,29)