2-[4-[(5-chloranylpyrazolo[1,5-a]pyrimidin-7-yl)-methyl-amino]phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-[(5-chloranylpyrazolo[1,5-a]pyrimidin-7-yl)-methyl-amino]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[(5-chloropyrazolo[1,5-a]pyrimidin-7-yl)-methyl-amino]phenyl]benzonitrile CAS Name: 2-[4-[(5-chloro-7-pyrazolo[1,5-a]pyrimidinyl)-methylamino]phenyl]benzonitrile IUPAC Name: 2-[4-[(5-chloropyrazolo[1,5-a]pyrimidin-7-yl)-methylamino]phenyl]benzonitrile Traditional Name: 2-[4-[(5-chloropyrazolo[1,5-a]pyrimidin-7-yl)-methyl-amino]phenyl]benzonitrile Formula: C20H14ClN5 MolecularWeight: 359.81166

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)C2=CC=CC=C2C#N)C3=CC(=NC4=CC=NN43)Cl

Isomeric SMILES

CN(C1=CC=C(C=C1)C2=CC=CC=C2C#N)C3=CC(=NC4=CC=NN43)Cl

InChI

InChI=1S/C20H14ClN5/c1-25(20-12-18(21)24-19-10-11-23-26(19)20)16-8-6-14(7-9-16)17-5-3-2-4-15(17)13-22/h2-12H,1H3