3-fluoranyl-4-(thiomorpholin-4-ylmethyl)benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-(thiomorpholin-4-ylmethyl)benzenecarbonitrile Openeye Name: 3-fluoro-4-(thiomorpholinomethyl)benzonitrile CAS Name: 3-fluoro-4-(thiomorpholin-4-ylmethyl)benzonitrile IUPAC Name: 3-fluoro-4-(thiomorpholin-4-ylmethyl)benzonitrile Traditional Name: 3-fluoro-4-(thiomorpholinomethyl)benzonitrile Formula: C12H13FN2S MolecularWeight: 236.308423

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1CC2=C(C=C(C=C2)C#N)F

Isomeric SMILES

C1CSCCN1CC2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C12H13FN2S/c13-12-7-10(8-14)1-2-11(12)9-15-3-5-16-6-4-15/h1-2,7H,3-6,9H2