2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-4H-3,1-benzothiazine

Systemtic Name: 2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-4H-3,1-benzothiazine Openeye Name: 2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-4H-3,1-benzothiazine CAS Name: 2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylthio]-4H-3,1-benzothiazine IUPAC Name: 2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-4H-3,1-benzothiazine Traditional Name: 2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylthio]-4H-3,1-benzothiazine Formula: C17H14N2O4S2 MolecularWeight: 374.43406

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CSC3=NC4=CC=CC=C4CS3)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CSC3=NC4=CC=CC=C4CS3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O4S2/c20-19(21)14-5-12-7-22-10-23-16(12)13(6-14)9-25-17-18-15-4-2-1-3-11(15)8-24-17/h1-6H,7-10H2