3-[[4-(chloromethyl)-5-methyl-2-phenyl-pyrazol-3-yl]-methyl-amino]propanenitrile

Systemtic Name: 3-[[4-(chloromethyl)-5-methyl-2-phenyl-pyrazol-3-yl]-methyl-amino]propanenitrile Openeye Name: 3-[[4-(chloromethyl)-5-methyl-2-phenyl-pyrazol-3-yl]-methyl-amino]propanenitrile CAS Name: 3-[[4-(chloromethyl)-5-methyl-2-phenyl-3-pyrazolyl]-methylamino]propanenitrile IUPAC Name: 3-[[4-(chloromethyl)-5-methyl-2-phenylpyrazol-3-yl]-methylamino]propanenitrile Traditional Name: 3-[[4-(chloromethyl)-5-methyl-2-phenyl-pyrazol-3-yl]-methyl-amino]propionitrile Formula: C15H17ClN4 MolecularWeight: 288.77528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CCl)N(C)CCC#N)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1CCl)N(C)CCC#N)C2=CC=CC=C2

InChI

InChI=1S/C15H17ClN4/c1-12-14(11-16)15(19(2)10-6-9-17)20(18-12)13-7-4-3-5-8-13/h3-5,7-8H,6,10-11H2,1-2H3