4-chloranyl-2,5-dimethyl-N-[(Z)-1-[3-(2-phenoxyethanoylamino)phenyl]ethylideneamino]pyrazole-3-carboxamide

Systemtic Name: 4-chloranyl-2,5-dimethyl-N-[(Z)-1-[3-(2-phenoxyethanoylamino)phenyl]ethylideneamino]pyrazole-3-carboxamide Openeye Name: 4-chloro-2,5-dimethyl-N-[(Z)-1-[3-[(2-phenoxyacetyl)amino]phenyl]ethylideneamino]pyrazole-3-carboxamide CAS Name: 4-chloro-2,5-dimethyl-N-[(Z)-1-[3-[(1-oxo-2-phenoxyethyl)amino]phenyl]ethylideneamino]-3-pyrazolecarboxamide IUPAC Name: 4-chloro-2,5-dimethyl-N-[(Z)-1-[3-[(2-phenoxyacetyl)amino]phenyl]ethylideneamino]pyrazole-3-carboxamide Traditional Name: 4-chloro-2,5-dimethyl-N-[(Z)-1-[3-[(2-phenoxyacetyl)amino]phenyl]ethylideneamino]pyrazole-3-carboxamide Formula: C22H22ClN5O3 MolecularWeight: 439.89478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1Cl)C(=O)NN=C(C)C2=CC(=CC=C2)NC(=O)COC3=CC=CC=C3)C

Isomeric SMILES

CC1=NN(C(=C1Cl)C(=O)N/N=C(/C)\C2=CC(=CC=C2)NC(=O)COC3=CC=CC=C3)C

InChI

InChI=1S/C22H22ClN5O3/c1-14(25-26-22(30)21-20(23)15(2)27-28(21)3)16-8-7-9-17(12-16)24-19(29)13-31-18-10-5-4-6-11-18/h4-12H,13H2,1-3H3,(H,24,29)(H,26,30)/b25-14-