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

Systemtic Name: ethyl 4-[2-[2-[(6-oxidanylidene-1H-pyridin-3-yl)carbonylamino]-1,3-thiazol-4-yl]ethanoylamino]benzoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C20H18N4O5S MolecularWeight: 426.44572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N4O5S/c1-2-29-19(28)12-3-6-14(7-4-12)22-17(26)9-15-11-30-20(23-15)24-18(27)13-5-8-16(25)21-10-13/h3-8,10-11H,2,9H2,1H3,(H,21,25)(H,22,26)(H,23,24,27)