5-azanyl-3-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]-1H-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-3-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]-1H-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]-1H-pyrazole-4-carbonitrile CAS Name: 5-amino-3-[4-[(3,4-dichlorophenyl)methyl]-1-piperazinyl]-1H-pyrazole-4-carbonitrile IUPAC Name: 5-amino-3-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]-1H-pyrazole-4-carbonitrile Traditional Name: 5-amino-3-[4-(3,4-dichlorobenzyl)piperazino]-1H-pyrazole-4-carbonitrile Formula: C15H16Cl2N6 MolecularWeight: 351.23374

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=C(C=C2)Cl)Cl)C3=NNC(=C3C#N)N

Isomeric SMILES

C1CN(CCN1CC2=CC(=C(C=C2)Cl)Cl)C3=NNC(=C3C#N)N

InChI

InChI=1S/C15H16Cl2N6/c16-12-2-1-10(7-13(12)17)9-22-3-5-23(6-4-22)15-11(8-18)14(19)20-21-15/h1-2,7H,3-6,9H2,(H3,19,20,21)