(2E)-2-(4,4-dimethyl-2-methylsulfanyl-3H-pyrrol-5-ylidene)ethanenitrile

Systemtic Name: (2E)-2-(4,4-dimethyl-2-methylsulfanyl-3H-pyrrol-5-ylidene)ethanenitrile Openeye Name: (2E)-2-(4,4-dimethyl-2-methylsulfanyl-3H-pyrrol-5-ylidene)acetonitrile CAS Name: (2E)-2-[4,4-dimethyl-2-(methylthio)-3H-pyrrol-5-ylidene]acetonitrile IUPAC Name: (2E)-2-(4,4-dimethyl-2-methylsulfanyl-3H-pyrrol-5-ylidene)acetonitrile Traditional Name: (2E)-2-[3,3-dimethyl-5-(methylthio)-1-pyrrolin-2-ylidene]acetonitrile Formula: C9H12N2S MolecularWeight: 180.26998

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=NC1=CC#N)SC)C

Isomeric SMILES

CC\1(CC(=N/C1=C/C#N)SC)C

InChI

InChI=1S/C9H12N2S/c1-9(2)6-8(12-3)11-7(9)4-5-10/h4H,6H2,1-3H3/b7-4+