2-[[3-(4-azanylpyrazol-1-yl)-2-oxidanyl-propyl]-(cyanomethyl)amino]ethanenitrile

Systemtic Name: 2-[[3-(4-azanylpyrazol-1-yl)-2-oxidanyl-propyl]-(cyanomethyl)amino]ethanenitrile Openeye Name: 2-[[3-(4-aminopyrazol-1-yl)-2-hydroxy-propyl]-(cyanomethyl)amino]acetonitrile CAS Name: 2-[[3-(4-amino-1-pyrazolyl)-2-hydroxypropyl]-(cyanomethyl)amino]acetonitrile IUPAC Name: 2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-(cyanomethyl)amino]acetonitrile Traditional Name: 2-[[3-(4-aminopyrazol-1-yl)-2-hydroxy-propyl]-(cyanomethyl)amino]acetonitrile Formula: C10H14N6O MolecularWeight: 234.25776

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NN1CC(CN(CC#N)CC#N)O)N

Isomeric SMILES

C1=C(C=NN1CC(CN(CC#N)CC#N)O)N

InChI

InChI=1S/C10H14N6O/c11-1-3-15(4-2-12)7-10(17)8-16-6-9(13)5-14-16/h5-6,10,17H,3-4,7-8,13H2