N'-[(E)-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]pyrazine-2-carboximidamide

Systemtic Name: N'-[(E)-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]pyrazine-2-carboximidamide Openeye Name: N'-[(E)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]pyrazine-2-carboxamidine CAS Name: N'-[(E)-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylideneamino]-2-pyrazinecarboximidamide IUPAC Name: N'-[(E)-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylideneamino]pyrazine-2-carboximidamide Traditional Name: N'-[(E)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]pyrazinamidine Formula: C16H14ClN7 MolecularWeight: 339.78226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NN=C(C2=NC=CN=C2)N)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1/C=N/N=C(\C2=NC=CN=C2)/N)Cl)C3=CC=CC=C3

InChI

InChI=1S/C16H14ClN7/c1-11-13(9-21-22-16(18)14-10-19-7-8-20-14)15(17)24(23-11)12-5-3-2-4-6-12/h2-10H,1H3,(H2,18,22)/b21-9+