2-(4-ethoxy-1-phenyl-pyrrol-2-yl)-2-methyl-3-sulfanyl-propanenitrile

Systemtic Name: 2-(4-ethoxy-1-phenyl-pyrrol-2-yl)-2-methyl-3-sulfanyl-propanenitrile Openeye Name: 2-(4-ethoxy-1-phenyl-pyrrol-2-yl)-2-methyl-3-sulfanyl-propanenitrile CAS Name: 2-(4-ethoxy-1-phenyl-2-pyrrolyl)-3-mercapto-2-methylpropanenitrile IUPAC Name: 2-(4-ethoxy-1-phenylpyrrol-2-yl)-2-methyl-3-sulfanylpropanenitrile Traditional Name: 2-(4-ethoxy-1-phenyl-pyrrol-2-yl)-3-mercapto-2-methyl-propionitrile Formula: C16H18N2OS MolecularWeight: 286.39192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CN(C(=C1)C(C)(CS)C#N)C2=CC=CC=C2

Isomeric SMILES

CCOC1=CN(C(=C1)C(C)(CS)C#N)C2=CC=CC=C2

InChI

InChI=1S/C16H18N2OS/c1-3-19-14-9-15(16(2,11-17)12-20)18(10-14)13-7-5-4-6-8-13/h4-10,20H,3,12H2,1-2H3