2-[4-[(4-diazanyl-6-propyl-pyrimidin-5-yl)methyl]phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-[(4-diazanyl-6-propyl-pyrimidin-5-yl)methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[(4-hydrazino-6-propyl-pyrimidin-5-yl)methyl]phenyl]benzonitrile CAS Name: 2-[4-[(4-hydrazinyl-6-propyl-5-pyrimidinyl)methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[(4-hydrazinyl-6-propylpyrimidin-5-yl)methyl]phenyl]benzonitrile Traditional Name: 2-[4-[(4-hydrazino-6-propyl-pyrimidin-5-yl)methyl]phenyl]benzonitrile Formula: C21H21N5 MolecularWeight: 343.42494

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=NC=N1)NN)CC2=CC=C(C=C2)C3=CC=CC=C3C#N

Isomeric SMILES

CCCC1=C(C(=NC=N1)NN)CC2=CC=C(C=C2)C3=CC=CC=C3C#N

InChI

InChI=1S/C21H21N5/c1-2-5-20-19(21(26-23)25-14-24-20)12-15-8-10-16(11-9-15)18-7-4-3-6-17(18)13-22/h3-4,6-11,14H,2,5,12,23H2,1H3,(H,24,25,26)