2-[4-[(4-chloranyl-5-propyl-7H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-[(4-chloranyl-5-propyl-7H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[(4-chloro-5-propyl-7H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzonitrile CAS Name: 2-[4-[(4-chloro-5-propyl-7H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[(4-chloro-5-propyl-7H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzonitrile Traditional Name: 2-[4-[(4-chloro-5-propyl-7H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzonitrile Formula: C23H21ClN4 MolecularWeight: 388.89264

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(CN2C(=CC=N2)N1Cl)CC3=CC=C(C=C3)C4=CC=CC=C4C#N

Isomeric SMILES

CCCC1=C(CN2C(=CC=N2)N1Cl)CC3=CC=C(C=C3)C4=CC=CC=C4C#N

InChI

InChI=1S/C23H21ClN4/c1-2-5-22-20(16-27-23(28(22)24)12-13-26-27)14-17-8-10-18(11-9-17)21-7-4-3-6-19(21)15-25/h3-4,6-13H,2,5,14,16H2,1H3