4-azanyl-N-[(E)-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]benzamide

Systemtic Name: 4-azanyl-N-[(E)-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]benzamide Openeye Name: 4-amino-N-[(E)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]benzamide CAS Name: 4-amino-N-[(E)-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylideneamino]benzamide IUPAC Name: 4-amino-N-[(E)-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylideneamino]benzamide Traditional Name: 4-amino-N-[(E)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]benzamide Formula: C18H16ClN5O MolecularWeight: 353.80554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC(=O)C2=CC=C(C=C2)N)Cl)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C18H16ClN5O/c1-12-16(17(19)24(23-12)15-5-3-2-4-6-15)11-21-22-18(25)13-7-9-14(20)10-8-13/h2-11H,20H2,1H3,(H,22,25)/b21-11+