benzo[b][1,4]benzothiazepin-6-amine; sulfuric acid

Systemtic Name: benzo[b][1,4]benzothiazepin-6-amine; sulfuric acid Openeye Name: benzo[b][1,4]benzothiazepin-6-amine; sulfuric acid CAS Name: 6-benzo[b][1,4]benzothiazepinamine; sulfuric acid IUPAC Name: benzo[b][1,4]benzothiazepin-6-amine; sulfuric acid Traditional Name: benzo[b][1,4]benzothiazepin-6-ylamine; sulfuric acid Formula: C13H12N2O4S2 MolecularWeight: 324.37538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC3=CC=CC=C3S2)N.OS(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC3=CC=CC=C3S2)N.OS(=O)(=O)O

InChI

InChI=1S/C13H10N2S.H2O4S/c14-13-9-5-1-3-7-11(9)16-12-8-4-2-6-10(12)15-13;1-5(2,3)4/h1-8H,(H2,14,15);(H2,1,2,3,4)