1-[5-(4-chlorophenyl)-1-prop-2-ynyl-4-pyridin-4-yl-pyrazol-3-yl]piperazine

Systemtic Name: 1-[5-(4-chlorophenyl)-1-prop-2-ynyl-4-pyridin-4-yl-pyrazol-3-yl]piperazine Openeye Name: 1-[5-(4-chlorophenyl)-1-prop-2-ynyl-4-(4-pyridyl)pyrazol-3-yl]piperazine CAS Name: 1-[5-(4-chlorophenyl)-1-prop-2-ynyl-4-pyridin-4-yl-3-pyrazolyl]piperazine IUPAC Name: 1-[5-(4-chlorophenyl)-1-prop-2-ynyl-4-pyridin-4-ylpyrazol-3-yl]piperazine Traditional Name: 1-[5-(4-chlorophenyl)-1-propargyl-4-(4-pyridyl)pyrazol-3-yl]piperazine Formula: C21H20ClN5 MolecularWeight: 377.87

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C(=C(C(=N1)N2CCNCC2)C3=CC=NC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C#CCN1C(=C(C(=N1)N2CCNCC2)C3=CC=NC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H20ClN5/c1-2-13-27-20(17-3-5-18(22)6-4-17)19(16-7-9-23-10-8-16)21(25-27)26-14-11-24-12-15-26/h1,3-10,24H,11-15H2