2-[(1-methyl-5-phenylsulfanyl-pyrrol-2-yl)methylidene]propanedinitrile

Systemtic Name: 2-[(1-methyl-5-phenylsulfanyl-pyrrol-2-yl)methylidene]propanedinitrile Openeye Name: 2-[(1-methyl-5-phenylsulfanyl-pyrrol-2-yl)methylene]propanedinitrile CAS Name: 2-[[1-methyl-5-(phenylthio)-2-pyrrolyl]methylidene]propanedinitrile IUPAC Name: 2-[(1-methyl-5-phenylsulfanylpyrrol-2-yl)methylidene]propanedinitrile Traditional Name: 2-[[1-methyl-5-(phenylthio)pyrrol-2-yl]methylene]malononitrile Formula: C15H11N3S MolecularWeight: 265.33294

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1SC2=CC=CC=C2)C=C(C#N)C#N

Isomeric SMILES

CN1C(=CC=C1SC2=CC=CC=C2)C=C(C#N)C#N

InChI

InChI=1S/C15H11N3S/c1-18-13(9-12(10-16)11-17)7-8-15(18)19-14-5-3-2-4-6-14/h2-9H,1H3