3-[methyl-[4-[(E)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]phenyl]amino]propanenitrile

Systemtic Name: 3-[methyl-[4-[(E)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]phenyl]amino]propanenitrile Openeye Name: 3-[N-methyl-4-[(E)-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]anilino]propanenitrile CAS Name: 3-[N-methyl-4-[(E)-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]anilino]propanenitrile IUPAC Name: 3-[N-methyl-4-[(E)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]anilino]propanenitrile Traditional Name: 3-[4-[(E)-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methyl]-N-methyl-anilino]propionitrile Formula: C21H20N4O MolecularWeight: 344.4097

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=C(C=C2)N(C)CCC#N)C3=CC=CC=C3

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CC=C(C=C2)N(C)CCC#N)C3=CC=CC=C3

InChI

InChI=1S/C21H20N4O/c1-16-20(21(26)25(23-16)19-7-4-3-5-8-19)15-17-9-11-18(12-10-17)24(2)14-6-13-22/h3-5,7-12,15H,6,14H2,1-2H3/b20-15+