3-[3-(5-methylfuran-2-yl)-4-[(Z)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]pyrazol-1-yl]propanenitrile

Systemtic Name: 3-[3-(5-methylfuran-2-yl)-4-[(Z)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]pyrazol-1-yl]propanenitrile Openeye Name: 3-[3-(5-methyl-2-furyl)-4-[(Z)-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]pyrazol-1-yl]propanenitrile CAS Name: 3-[3-(5-methyl-2-furanyl)-4-[(Z)-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]-1-pyrazolyl]propanenitrile IUPAC Name: 3-[3-(5-methylfuran-2-yl)-4-[(Z)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]pyrazol-1-yl]propanenitrile Traditional Name: 3-[4-[(Z)-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methyl]-3-(5-methyl-2-furyl)pyrazol-1-yl]propionitrile Formula: C22H19N5O2 MolecularWeight: 385.41856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NN(C=C2C=C3C(=NN(C3=O)C4=CC=CC=C4)C)CCC#N

Isomeric SMILES

CC1=CC=C(O1)C2=NN(C=C2/C=C\3/C(=NN(C3=O)C4=CC=CC=C4)C)CCC#N

InChI

InChI=1S/C22H19N5O2/c1-15-9-10-20(29-15)21-17(14-26(25-21)12-6-11-23)13-19-16(2)24-27(22(19)28)18-7-4-3-5-8-18/h3-5,7-10,13-14H,6,12H2,1-2H3/b19-13-