5-azanyl-3-[4-(2-phenoxyethyl)piperazin-1-yl]-1H-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-3-[4-(2-phenoxyethyl)piperazin-1-yl]-1H-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-[4-(2-phenoxyethyl)piperazin-1-yl]-1H-pyrazole-4-carbonitrile CAS Name: 5-amino-3-[4-(2-phenoxyethyl)-1-piperazinyl]-1H-pyrazole-4-carbonitrile IUPAC Name: 5-amino-3-[4-(2-phenoxyethyl)piperazin-1-yl]-1H-pyrazole-4-carbonitrile Traditional Name: 5-amino-3-[4-(2-phenoxyethyl)piperazino]-1H-pyrazole-4-carbonitrile Formula: C16H20N6O MolecularWeight: 312.3696

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC2=CC=CC=C2)C3=NNC(=C3C#N)N

Isomeric SMILES

C1CN(CCN1CCOC2=CC=CC=C2)C3=NNC(=C3C#N)N

InChI

InChI=1S/C16H20N6O/c17-12-14-15(18)19-20-16(14)22-8-6-21(7-9-22)10-11-23-13-4-2-1-3-5-13/h1-5H,6-11H2,(H3,18,19,20)