5-isothiocyanato-6-(4-nitrophenyl)-2,3-dihydro-1,4-dithiine

Systemtic Name: 5-isothiocyanato-6-(4-nitrophenyl)-2,3-dihydro-1,4-dithiine Openeye Name: 5-isothiocyanato-6-(4-nitrophenyl)-2,3-dihydro-1,4-dithiine CAS Name: 5-isothiocyanato-6-(4-nitrophenyl)-2,3-dihydro-1,4-dithiin IUPAC Name: 5-isothiocyanato-6-(4-nitrophenyl)-2,3-dihydro-1,4-dithiine Traditional Name: 5-isothiocyanato-6-(4-nitrophenyl)-2,3-dihydro-1,4-dithiin Formula: C11H8N2O2S3 MolecularWeight: 296.38842

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=C(S1)C2=CC=C(C=C2)[N+](=O)[O-])N=C=S

Isomeric SMILES

C1CSC(=C(S1)C2=CC=C(C=C2)[N+](=O)[O-])N=C=S

InChI

InChI=1S/C11H8N2O2S3/c14-13(15)9-3-1-8(2-4-9)10-11(12-7-16)18-6-5-17-10/h1-4H,5-6H2