4-methyl-N-[(E)-[pyridazin-4-yl(pyridin-2-yl)methylidene]amino]piperazine-1-carbothioamide

Systemtic Name: 4-methyl-N-[(E)-[pyridazin-4-yl(pyridin-2-yl)methylidene]amino]piperazine-1-carbothioamide Openeye Name: 4-methyl-N-[(E)-[pyridazin-4-yl(2-pyridyl)methylene]amino]piperazine-1-carbothioamide CAS Name: 4-methyl-N-[(E)-[4-pyridazinyl(2-pyridinyl)methylidene]amino]-1-piperazinecarbothioamide IUPAC Name: 4-methyl-N-[(E)-[pyridazin-4-yl(pyridin-2-yl)methylidene]amino]piperazine-1-carbothioamide Traditional Name: 4-methyl-N-[(E)-[pyridazin-4-yl(2-pyridyl)methylene]amino]piperazine-1-carbothioamide Formula: C16H19N7S MolecularWeight: 341.43396

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=S)NN=C(C2=CN=NC=C2)C3=CC=CC=N3

Isomeric SMILES

CN1CCN(CC1)C(=S)N/N=C(\C2=CN=NC=C2)/C3=CC=CC=N3

InChI

InChI=1S/C16H19N7S/c1-22-8-10-23(11-9-22)16(24)21-20-15(13-5-7-18-19-12-13)14-4-2-3-6-17-14/h2-7,12H,8-11H2,1H3,(H,21,24)/b20-15+