3-(4-chlorophenyl)-N-[(E)-1-(4-ethoxyphenyl)propylideneamino]-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(4-chlorophenyl)-N-[(E)-1-(4-ethoxyphenyl)propylideneamino]-1H-pyrazole-5-carboxamide Openeye Name: 3-(4-chlorophenyl)-N-[(E)-1-(4-ethoxyphenyl)propylideneamino]-1H-pyrazole-5-carboxamide CAS Name: 3-(4-chlorophenyl)-N-[(E)-1-(4-ethoxyphenyl)propylideneamino]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(4-chlorophenyl)-N-[(E)-1-(4-ethoxyphenyl)propylideneamino]-1H-pyrazole-5-carboxamide Traditional Name: 3-(4-chlorophenyl)-N-[(E)-1-p-phenetylpropylideneamino]-1H-pyrazole-5-carboxamide Formula: C21H21ClN4O2 MolecularWeight: 396.87004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNC(=O)C1=CC(=NN1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)OCC

Isomeric SMILES

CC/C(=N\NC(=O)C1=CC(=NN1)C2=CC=C(C=C2)Cl)/C3=CC=C(C=C3)OCC

InChI

InChI=1S/C21H21ClN4O2/c1-3-18(14-7-11-17(12-8-14)28-4-2)23-26-21(27)20-13-19(24-25-20)15-5-9-16(22)10-6-15/h5-13H,3-4H2,1-2H3,(H,24,25)(H,26,27)/b23-18+