[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propanoate CAS Name: 3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoate Traditional Name: 3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propionic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C14H14N4O4S MolecularWeight: 334.35036

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NOC(=N2)CCC(=O)OCC(=O)NCCC#N

Isomeric SMILES

C1=CSC(=C1)C2=NOC(=N2)CCC(=O)OCC(=O)NCCC#N

InChI

InChI=1S/C14H14N4O4S/c15-6-2-7-16-11(19)9-21-13(20)5-4-12-17-14(18-22-12)10-3-1-8-23-10/h1,3,8H,2,4-5,7,9H2,(H,16,19)