3-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-oxidanylidene-1,3-thiazolidin-3-yl]propanenitrile

Systemtic Name: 3-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-oxidanylidene-1,3-thiazolidin-3-yl]propanenitrile Openeye Name: 3-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-oxo-thiazolidin-3-yl]propanenitrile CAS Name: 3-[2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-4-oxo-3-thiazolidinyl]propanenitrile IUPAC Name: 3-[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-4-oxo-1,3-thiazolidin-3-yl]propanenitrile Traditional Name: 3-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-keto-thiazolidin-3-yl]propionitrile Formula: C17H18N4OS MolecularWeight: 326.41602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C3N(C(=O)CS3)CCC#N

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C3N(C(=O)CS3)CCC#N

InChI

InChI=1S/C17H18N4OS/c1-12-16(17-20(10-6-9-18)15(22)11-23-17)13(2)21(19-12)14-7-4-3-5-8-14/h3-5,7-8,17H,6,10-11H2,1-2H3