4-chloranyl-2-methyl-N-[(E)-1-[3-[(4-methylphenyl)carbonylamino]phenyl]ethylideneamino]pyrazole-3-carboxamide

Systemtic Name: 4-chloranyl-2-methyl-N-[(E)-1-[3-[(4-methylphenyl)carbonylamino]phenyl]ethylideneamino]pyrazole-3-carboxamide Openeye Name: 4-chloro-2-methyl-N-[(E)-1-[3-[(4-methylbenzoyl)amino]phenyl]ethylideneamino]pyrazole-3-carboxamide CAS Name: 4-chloro-2-methyl-N-[(E)-1-[3-[[(4-methylphenyl)-oxomethyl]amino]phenyl]ethylideneamino]-3-pyrazolecarboxamide IUPAC Name: 4-chloro-2-methyl-N-[(E)-1-[3-[(4-methylbenzoyl)amino]phenyl]ethylideneamino]pyrazole-3-carboxamide Traditional Name: 4-chloro-2-methyl-N-[(E)-1-[3-(p-toluoylamino)phenyl]ethylideneamino]pyrazole-3-carboxamide Formula: C21H20ClN5O2 MolecularWeight: 409.8688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C(=NNC(=O)C3=C(C=NN3C)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)/C(=N/NC(=O)C3=C(C=NN3C)Cl)/C

InChI

InChI=1S/C21H20ClN5O2/c1-13-7-9-15(10-8-13)20(28)24-17-6-4-5-16(11-17)14(2)25-26-21(29)19-18(22)12-23-27(19)3/h4-12H,1-3H3,(H,24,28)(H,26,29)/b25-14+