4-methyl-N-[(Z)-[phenyl(pyrimidin-2-yl)methylidene]amino]piperazine-1-carbothioamide

Systemtic Name: 4-methyl-N-[(Z)-[phenyl(pyrimidin-2-yl)methylidene]amino]piperazine-1-carbothioamide Openeye Name: 4-methyl-N-[(Z)-[phenyl(pyrimidin-2-yl)methylene]amino]piperazine-1-carbothioamide CAS Name: 4-methyl-N-[(Z)-[phenyl(2-pyrimidinyl)methylidene]amino]-1-piperazinecarbothioamide IUPAC Name: 4-methyl-N-[(Z)-[phenyl(pyrimidin-2-yl)methylidene]amino]piperazine-1-carbothioamide Traditional Name: 4-methyl-N-[(Z)-[phenyl(2-pyrimidyl)methylene]amino]piperazine-1-carbothioamide Formula: C17H20N6S MolecularWeight: 340.4459

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N6S/c1-22-10-12-23(13-11-22)17(24)21-20-15(14-6-3-2-4-7-14)16-18-8-5-9-19-16/h2-9H,10-13H2,1H3,(H,21,24)/b20-15-