5-azanyl-3-[4-(4-phenoxybutyl)piperazin-1-yl]-1H-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-3-[4-(4-phenoxybutyl)piperazin-1-yl]-1H-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-[4-(4-phenoxybutyl)piperazin-1-yl]-1H-pyrazole-4-carbonitrile CAS Name: 5-amino-3-[4-(4-phenoxybutyl)-1-piperazinyl]-1H-pyrazole-4-carbonitrile IUPAC Name: 5-amino-3-[4-(4-phenoxybutyl)piperazin-1-yl]-1H-pyrazole-4-carbonitrile Traditional Name: 5-amino-3-[4-(4-phenoxybutyl)piperazino]-1H-pyrazole-4-carbonitrile Formula: C18H24N6O MolecularWeight: 340.42276

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCOC2=CC=CC=C2)C3=NNC(=C3C#N)N

Isomeric SMILES

C1CN(CCN1CCCCOC2=CC=CC=C2)C3=NNC(=C3C#N)N

InChI

InChI=1S/C18H24N6O/c19-14-16-17(20)21-22-18(16)24-11-9-23(10-12-24)8-4-5-13-25-15-6-2-1-3-7-15/h1-3,6-7H,4-5,8-13H2,(H3,20,21,22)