cyanomethyl 3-[2-(4-oxidanylidene-2-piperidin-1-yl-1,3-thiazol-5-yl)ethanoylamino]benzoate

Systemtic Name: cyanomethyl 3-[2-(4-oxidanylidene-2-piperidin-1-yl-1,3-thiazol-5-yl)ethanoylamino]benzoate Openeye Name: cyanomethyl 3-[[2-[4-oxo-2-(1-piperidyl)thiazol-5-yl]acetyl]amino]benzoate CAS Name: 3-[[1-oxo-2-[4-oxo-2-(1-piperidinyl)-5-thiazolyl]ethyl]amino]benzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 3-[[2-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-yl)acetyl]amino]benzoate Traditional Name: 3-[[2-(4-keto-2-piperidino-2-thiazolin-5-yl)acetyl]amino]benzoic acid cyanomethyl ester Formula: C19H20N4O4S MolecularWeight: 400.4515

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=O)C(S2)CC(=O)NC3=CC=CC(=C3)C(=O)OCC#N

Isomeric SMILES

C1CCN(CC1)C2=NC(=O)C(S2)CC(=O)NC3=CC=CC(=C3)C(=O)OCC#N

InChI

InChI=1S/C19H20N4O4S/c20-7-10-27-18(26)13-5-4-6-14(11-13)21-16(24)12-15-17(25)22-19(28-15)23-8-2-1-3-9-23/h4-6,11,15H,1-3,8-10,12H2,(H,21,24)