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

Systemtic Name: 5-azanyl-3-[4-(3-phenoxypropyl)piperazin-1-yl]-1H-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-[4-(3-phenoxypropyl)piperazin-1-yl]-1H-pyrazole-4-carbonitrile CAS Name: 5-amino-3-[4-(3-phenoxypropyl)-1-piperazinyl]-1H-pyrazole-4-carbonitrile IUPAC Name: 5-amino-3-[4-(3-phenoxypropyl)piperazin-1-yl]-1H-pyrazole-4-carbonitrile Traditional Name: 5-amino-3-[4-(3-phenoxypropyl)piperazino]-1H-pyrazole-4-carbonitrile Formula: C17H22N6O MolecularWeight: 326.39618

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCOC2=CC=CC=C2)C3=NNC(=C3C#N)N

Isomeric SMILES

C1CN(CCN1CCCOC2=CC=CC=C2)C3=NNC(=C3C#N)N

InChI

InChI=1S/C17H22N6O/c18-13-15-16(19)20-21-17(15)23-10-8-22(9-11-23)7-4-12-24-14-5-2-1-3-6-14/h1-3,5-6H,4,7-12H2,(H3,19,20,21)