2-[[5-azanyl-2-[2-(4-chlorophenyl)ethanoyl]-3-oxidanylidene-1H-pyrazol-4-yl]methylidene]propanedinitrile

Systemtic Name: 2-[[5-azanyl-2-[2-(4-chlorophenyl)ethanoyl]-3-oxidanylidene-1H-pyrazol-4-yl]methylidene]propanedinitrile Openeye Name: 2-[[5-amino-2-[2-(4-chlorophenyl)acetyl]-3-oxo-1H-pyrazol-4-yl]methylene]propanedinitrile CAS Name: 2-[[5-amino-2-[2-(4-chlorophenyl)-1-oxoethyl]-3-oxo-1H-pyrazol-4-yl]methylidene]propanedinitrile IUPAC Name: 2-[[5-amino-2-[2-(4-chlorophenyl)acetyl]-3-oxo-1H-pyrazol-4-yl]methylidene]propanedinitrile Traditional Name: 2-[[3-amino-1-[2-(4-chlorophenyl)acetyl]-5-keto-3-pyrazolin-4-yl]methylene]malononitrile Formula: C15H10ClN5O2 MolecularWeight: 327.7252

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)N2C(=O)C(=C(N2)N)C=C(C#N)C#N)Cl

Isomeric SMILES

C1=CC(=CC=C1CC(=O)N2C(=O)C(=C(N2)N)C=C(C#N)C#N)Cl

InChI

InChI=1S/C15H10ClN5O2/c16-11-3-1-9(2-4-11)6-13(22)21-15(23)12(14(19)20-21)5-10(7-17)8-18/h1-5,20H,6,19H2