1-ethyl-5-phenylsulfanyl-pyrrole-2-carbonitrile

Systemtic Name: 1-ethyl-5-phenylsulfanyl-pyrrole-2-carbonitrile Openeye Name: 1-ethyl-5-phenylsulfanyl-pyrrole-2-carbonitrile CAS Name: 1-ethyl-5-(phenylthio)-2-pyrrolecarbonitrile IUPAC Name: 1-ethyl-5-phenylsulfanylpyrrole-2-carbonitrile Traditional Name: 1-ethyl-5-(phenylthio)pyrrole-2-carbonitrile Formula: C13H12N2S MolecularWeight: 228.31278

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=C1SC2=CC=CC=C2)C#N

Isomeric SMILES

CCN1C(=CC=C1SC2=CC=CC=C2)C#N

InChI

InChI=1S/C13H12N2S/c1-2-15-11(10-14)8-9-13(15)16-12-6-4-3-5-7-12/h3-9H,2H2,1H3