1-[4-cyano-2-(furan-2-yl)-1,3-oxazol-5-yl]-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)piperidine-4-carboxamide

Systemtic Name: 1-[4-cyano-2-(furan-2-yl)-1,3-oxazol-5-yl]-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)piperidine-4-carboxamide Openeye Name: 1-[4-cyano-2-(2-furyl)oxazol-5-yl]-N-(5-thioxo-1H-1,2,4-triazol-4-yl)piperidine-4-carboxamide CAS Name: 1-[4-cyano-2-(2-furanyl)-5-oxazolyl]-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)-4-piperidinecarboxamide IUPAC Name: 1-[4-cyano-2-(furan-2-yl)-1,3-oxazol-5-yl]-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)piperidine-4-carboxamide Traditional Name: 1-[4-cyano-2-(2-furyl)oxazol-5-yl]-N-(5-thioxo-1H-1,2,4-triazol-4-yl)isonipecotamide Formula: C16H15N7O3S MolecularWeight: 385.4004

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NN2C=NNC2=S)C3=C(N=C(O3)C4=CC=CO4)C#N

Isomeric SMILES

C1CN(CCC1C(=O)NN2C=NNC2=S)C3=C(N=C(O3)C4=CC=CO4)C#N

InChI

InChI=1S/C16H15N7O3S/c17-8-11-15(26-14(19-11)12-2-1-7-25-12)22-5-3-10(4-6-22)13(24)21-23-9-18-20-16(23)27/h1-2,7,9-10H,3-6H2,(H,20,27)(H,21,24)