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

Systemtic Name: butyl 4-[2-[2-[(2-oxidanylidene-1H-pyridin-3-yl)carbonylamino]-1,3-thiazol-4-yl]ethanoylamino]benzoate Openeye Name: butyl 4-[[2-[2-[(2-oxo-1H-pyridine-3-carbonyl)amino]thiazol-4-yl]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[2-[[oxo-(2-oxo-1H-pyridin-3-yl)methyl]amino]-4-thiazolyl]ethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[2-[(2-oxo-1H-pyridine-3-carbonyl)amino]-1,3-thiazol-4-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[2-[(2-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=CC=CNC3=O

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)NC(=O)C3=CC=CNC3=O

InChI

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