3-[[3-(4-azanylpyrazol-1-yl)-2-oxidanyl-propyl]-phenyl-amino]propanenitrile

Systemtic Name: 3-[[3-(4-azanylpyrazol-1-yl)-2-oxidanyl-propyl]-phenyl-amino]propanenitrile Openeye Name: 3-(N-[3-(4-aminopyrazol-1-yl)-2-hydroxy-propyl]anilino)propanenitrile CAS Name: 3-(N-[3-(4-amino-1-pyrazolyl)-2-hydroxypropyl]anilino)propanenitrile IUPAC Name: 3-(N-[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]anilino)propanenitrile Traditional Name: 3-(N-[3-(4-aminopyrazol-1-yl)-2-hydroxy-propyl]anilino)propionitrile Formula: C15H19N5O MolecularWeight: 285.34426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCC#N)CC(CN2C=C(C=N2)N)O

Isomeric SMILES

C1=CC=C(C=C1)N(CCC#N)CC(CN2C=C(C=N2)N)O

InChI

InChI=1S/C15H19N5O/c16-7-4-8-19(14-5-2-1-3-6-14)11-15(21)12-20-10-13(17)9-18-20/h1-3,5-6,9-10,15,21H,4,8,11-12,17H2