3-thiomorpholin-4-ylcarbonylbenzenecarbonitrile

Systemtic Name: 3-thiomorpholin-4-ylcarbonylbenzenecarbonitrile Openeye Name: 3-(thiomorpholine-4-carbonyl)benzonitrile CAS Name: 3-[oxo(thiomorpholin-4-yl)methyl]benzonitrile IUPAC Name: 3-(thiomorpholine-4-carbonyl)benzonitrile Traditional Name: 3-(thiomorpholine-4-carbonyl)benzonitrile Formula: C12H12N2OS MolecularWeight: 232.30148

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1C(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

C1CSCCN1C(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C12H12N2OS/c13-9-10-2-1-3-11(8-10)12(15)14-4-6-16-7-5-14/h1-3,8H,4-7H2