3,5-dimethyl-N-[2-oxidanylidene-2-[(1-phenylpyrazol-4-yl)methylamino]ethyl]benzamide

Systemtic Name: 3,5-dimethyl-N-[2-oxidanylidene-2-[(1-phenylpyrazol-4-yl)methylamino]ethyl]benzamide Openeye Name: 3,5-dimethyl-N-[2-oxo-2-[(1-phenylpyrazol-4-yl)methylamino]ethyl]benzamide CAS Name: 3,5-dimethyl-N-[2-oxo-2-[(1-phenyl-4-pyrazolyl)methylamino]ethyl]benzamide IUPAC Name: 3,5-dimethyl-N-[2-oxo-2-[(1-phenylpyrazol-4-yl)methylamino]ethyl]benzamide Traditional Name: N-[2-keto-2-[(1-phenylpyrazol-4-yl)methylamino]ethyl]-3,5-dimethyl-benzamide Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NCC(=O)NCC2=CN(N=C2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NCC(=O)NCC2=CN(N=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C21H22N4O2/c1-15-8-16(2)10-18(9-15)21(27)23-13-20(26)22-11-17-12-24-25(14-17)19-6-4-3-5-7-19/h3-10,12,14H,11,13H2,1-2H3,(H,22,26)(H,23,27)