2-[[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]methylidene]propanedinitrile

Systemtic Name: 2-[[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]methylidene]propanedinitrile Openeye Name: 2-[[1-benzyl-3-(2-thienyl)pyrazol-4-yl]methylene]propanedinitrile CAS Name: 2-[[1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]methylidene]propanedinitrile IUPAC Name: 2-[(1-benzyl-3-thiophen-2-ylpyrazol-4-yl)methylidene]propanedinitrile Traditional Name: 2-[[1-benzyl-3-(2-thienyl)pyrazol-4-yl]methylene]malononitrile Formula: C18H12N4S MolecularWeight: 316.37968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)C=C(C#N)C#N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)C=C(C#N)C#N

InChI

InChI=1S/C18H12N4S/c19-10-15(11-20)9-16-13-22(12-14-5-2-1-3-6-14)21-18(16)17-7-4-8-23-17/h1-9,13H,12H2