5-nitro-2-(thiolan-3-ylamino)benzenecarbonitrile

Systemtic Name: 5-nitro-2-(thiolan-3-ylamino)benzenecarbonitrile Openeye Name: 5-nitro-2-(tetrahydrothiophen-3-ylamino)benzonitrile CAS Name: 5-nitro-2-(3-thiolanylamino)benzonitrile IUPAC Name: 5-nitro-2-(thiolan-3-ylamino)benzonitrile Traditional Name: 5-nitro-2-(tetrahydrothiophen-3-ylamino)benzonitrile Formula: C11H11N3O2S MolecularWeight: 249.28894

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC1NC2=C(C=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

C1CSCC1NC2=C(C=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C11H11N3O2S/c12-6-8-5-10(14(15)16)1-2-11(8)13-9-3-4-17-7-9/h1-2,5,9,13H,3-4,7H2