N-[(E)-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methylideneamino]-2-phenylazanyl-ethanamide

Systemtic Name: N-[(E)-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methylideneamino]-2-phenylazanyl-ethanamide Openeye Name: 2-anilino-N-[(E)-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyleneamino]acetamide CAS Name: 2-anilino-N-[(E)-[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methylideneamino]acetamide IUPAC Name: 2-anilino-N-[(E)-(1-benzyl-3,5-dimethylpyrazol-4-yl)methylideneamino]acetamide Traditional Name: 2-anilino-N-[(E)-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyleneamino]acetamide Formula: C21H23N5O MolecularWeight: 361.44022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)C=NNC(=O)CNC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)/C=N/NC(=O)CNC3=CC=CC=C3

InChI

InChI=1S/C21H23N5O/c1-16-20(17(2)26(25-16)15-18-9-5-3-6-10-18)13-23-24-21(27)14-22-19-11-7-4-8-12-19/h3-13,22H,14-15H2,1-2H3,(H,24,27)/b23-13+