2-[ethylsulfanyl-(2,4,5-trimethyl-1H-pyrrol-3-yl)methylidene]propanedinitrile

Systemtic Name: 2-[ethylsulfanyl-(2,4,5-trimethyl-1H-pyrrol-3-yl)methylidene]propanedinitrile Openeye Name: 2-[ethylsulfanyl-(2,4,5-trimethyl-1H-pyrrol-3-yl)methylene]propanedinitrile CAS Name: 2-[(ethylthio)-(2,4,5-trimethyl-1H-pyrrol-3-yl)methylidene]propanedinitrile IUPAC Name: 2-[ethylsulfanyl-(2,4,5-trimethyl-1H-pyrrol-3-yl)methylidene]propanedinitrile Traditional Name: 2-[(ethylthio)-(2,4,5-trimethyl-1H-pyrrol-3-yl)methylene]malononitrile Formula: C13H15N3S MolecularWeight: 245.3433

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=C(C#N)C#N)C1=C(NC(=C1C)C)C

Isomeric SMILES

CCSC(=C(C#N)C#N)C1=C(NC(=C1C)C)C

InChI

InChI=1S/C13H15N3S/c1-5-17-13(11(6-14)7-15)12-8(2)9(3)16-10(12)4/h16H,5H2,1-4H3