4-bromanyl-2,5-dimethyl-N-[(E)-1-[3-[(2-methylphenyl)carbonylamino]phenyl]ethylideneamino]pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-2,5-dimethyl-N-[(E)-1-[3-[(2-methylphenyl)carbonylamino]phenyl]ethylideneamino]pyrazole-3-carboxamide Openeye Name: 4-bromo-2,5-dimethyl-N-[(E)-1-[3-[(2-methylbenzoyl)amino]phenyl]ethylideneamino]pyrazole-3-carboxamide CAS Name: 4-bromo-2,5-dimethyl-N-[(E)-1-[3-[[(2-methylphenyl)-oxomethyl]amino]phenyl]ethylideneamino]-3-pyrazolecarboxamide IUPAC Name: 4-bromo-2,5-dimethyl-N-[(E)-1-[3-[(2-methylbenzoyl)amino]phenyl]ethylideneamino]pyrazole-3-carboxamide Traditional Name: 4-bromo-2,5-dimethyl-N-[(E)-1-[3-(o-toluoylamino)phenyl]ethylideneamino]pyrazole-3-carboxamide Formula: C22H22BrN5O2 MolecularWeight: 468.34638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC=CC(=C2)C(=NNC(=O)C3=C(C(=NN3C)C)Br)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC=CC(=C2)/C(=N/NC(=O)C3=C(C(=NN3C)C)Br)/C

InChI

InChI=1S/C22H22BrN5O2/c1-13-8-5-6-11-18(13)21(29)24-17-10-7-9-16(12-17)14(2)25-26-22(30)20-19(23)15(3)27-28(20)4/h5-12H,1-4H3,(H,24,29)(H,26,30)/b25-14+