4-chloranyl-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-N-propyl-benzamide

Systemtic Name: 4-chloranyl-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-N-propyl-benzamide Openeye Name: 4-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-N-propyl-benzamide CAS Name: 4-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-N-propylbenzamide IUPAC Name: 4-chloro-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-N-propylbenzamide Traditional Name: 4-chloro-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-N-propyl-benzamide Formula: C21H22ClN3O2 MolecularWeight: 383.87128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=C(N(N(C1=O)C2=CC=CC=C2)C)C)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCN(C1=C(N(N(C1=O)C2=CC=CC=C2)C)C)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H22ClN3O2/c1-4-14-24(20(26)16-10-12-17(22)13-11-16)19-15(2)23(3)25(21(19)27)18-8-6-5-7-9-18/h5-13H,4,14H2,1-3H3