1-[5-(4-isocyanophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-4-methyl-piperazine

Systemtic Name: 1-[5-(4-isocyanophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-4-methyl-piperazine Openeye Name: 1-[5-(4-isocyanophenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]-4-methyl-piperazine CAS Name: 1-[5-(4-isocyanophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-4-methylpiperazine IUPAC Name: 1-[5-(4-isocyanophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-4-methylpiperazine Traditional Name: 1-[5-(4-isocyanophenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]-4-methyl-piperazine Formula: C20H20N6 MolecularWeight: 344.413

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NNC(=C2C3=CC=NC=C3)C4=CC=C(C=C4)[N+]#[C-]

Isomeric SMILES

CN1CCN(CC1)C2=NNC(=C2C3=CC=NC=C3)C4=CC=C(C=C4)[N+]#[C-]

InChI

InChI=1S/C20H20N6/c1-21-17-5-3-16(4-6-17)19-18(15-7-9-22-10-8-15)20(24-23-19)26-13-11-25(2)12-14-26/h3-10H,11-14H2,2H3,(H,23,24)