2-[[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-methylsulfanyl-methylidene]propanedinitrile

Systemtic Name: 2-[[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-methylsulfanyl-methylidene]propanedinitrile Openeye Name: 2-[[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]-methylsulfanyl-methylene]propanedinitrile CAS Name: 2-[[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-(methylthio)methylidene]propanedinitrile IUPAC Name: 2-[[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-methylsulfanylmethylidene]propanedinitrile Traditional Name: 2-[[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]-(methylthio)methylene]malononitrile Formula: C16H15N5OS MolecularWeight: 325.3882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=C(C#N)C#N)SC

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=C(C#N)C#N)SC

InChI

InChI=1S/C16H15N5OS/c1-11-14(19-15(23-3)12(9-17)10-18)16(22)21(20(11)2)13-7-5-4-6-8-13/h4-8,19H,1-3H3