2-[4-(4-cyano-2-cyclopropyl-1,3-oxazol-5-yl)piperazin-1-ium-1-yl]-N-(prop-2-enylcarbamoyl)ethanamide

Systemtic Name: 2-[4-(4-cyano-2-cyclopropyl-1,3-oxazol-5-yl)piperazin-1-ium-1-yl]-N-(prop-2-enylcarbamoyl)ethanamide Openeye Name: N-(allylcarbamoyl)-2-[4-(4-cyano-2-cyclopropyl-oxazol-5-yl)piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-(4-cyano-2-cyclopropyl-5-oxazolyl)-1-piperazin-1-iumyl]-N-[oxo-(prop-2-enylamino)methyl]acetamide IUPAC Name: 2-[4-(4-cyano-2-cyclopropyl-1,3-oxazol-5-yl)piperazin-1-ium-1-yl]-N-(prop-2-enylcarbamoyl)acetamide Traditional Name: N-(allylcarbamoyl)-2-[4-(4-cyano-2-cyclopropyl-oxazol-5-yl)piperazin-1-ium-1-yl]acetamide Formula: C17H23N6O3+ MolecularWeight: 359.40292

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)C[NH+]1CCN(CC1)C2=C(N=C(O2)C3CC3)C#N

Isomeric SMILES

C=CCNC(=O)NC(=O)C[NH+]1CCN(CC1)C2=C(N=C(O2)C3CC3)C#N

InChI

InChI=1S/C17H22N6O3/c1-2-5-19-17(25)21-14(24)11-22-6-8-23(9-7-22)16-13(10-18)20-15(26-16)12-3-4-12/h2,12H,1,3-9,11H2,(H2,19,21,24,25)/p+1