(4Z)-4-[1-[(4-chloranyl-2-methyl-phenyl)amino]ethylidene]-2-phenyl-5-propyl-pyrazol-3-one

Systemtic Name: (4Z)-4-[1-[(4-chloranyl-2-methyl-phenyl)amino]ethylidene]-2-phenyl-5-propyl-pyrazol-3-one Openeye Name: (4Z)-4-[1-(4-chloro-2-methyl-anilino)ethylidene]-2-phenyl-5-propyl-pyrazol-3-one CAS Name: (4Z)-4-[1-(4-chloro-2-methylanilino)ethylidene]-2-phenyl-5-propyl-3-pyrazolone IUPAC Name: (4Z)-4-[1-(4-chloro-2-methylanilino)ethylidene]-2-phenyl-5-propylpyrazol-3-one Traditional Name: (4Z)-4-[1-(4-chloro-2-methyl-anilino)ethylidene]-2-phenyl-5-propyl-2-pyrazolin-3-one Formula: C21H22ClN3O MolecularWeight: 367.87188

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=C(C)NC2=C(C=C(C=C2)Cl)C)C3=CC=CC=C3

Isomeric SMILES

CCCC\1=NN(C(=O)/C1=C(/C)\NC2=C(C=C(C=C2)Cl)C)C3=CC=CC=C3

InChI

InChI=1S/C21H22ClN3O/c1-4-8-19-20(15(3)23-18-12-11-16(22)13-14(18)2)21(26)25(24-19)17-9-6-5-7-10-17/h5-7,9-13,23H,4,8H2,1-3H3/b20-15-