2-(methylamino)-4,5-dihydro-1,3-benzothiazepine-7,8-diol

Systemtic Name: 2-(methylamino)-4,5-dihydro-1,3-benzothiazepine-7,8-diol Openeye Name: 2-(methylamino)-4,5-dihydro-1,3-benzothiazepine-7,8-diol CAS Name: 2-(methylamino)-4,5-dihydro-1,3-benzothiazepine-7,8-diol IUPAC Name: 2-(methylamino)-4,5-dihydro-1,3-benzothiazepine-7,8-diol Traditional Name: 2-(methylamino)-4,5-dihydro-1,3-benzothiazepine-7,8-diol Formula: C10H12N2O2S MolecularWeight: 224.27948

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NCCC2=CC(=C(C=C2S1)O)O

Isomeric SMILES

CNC1=NCCC2=CC(=C(C=C2S1)O)O

InChI

InChI=1S/C10H12N2O2S/c1-11-10-12-3-2-6-4-7(13)8(14)5-9(6)15-10/h4-5,13-14H,2-3H2,1H3,(H,11,12)