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

Systemtic Name: benzo[b][1,4]benzothiazepin-6-amine; ethanoic acid Openeye Name: acetic acid; benzo[b][1,4]benzothiazepin-6-amine CAS Name: acetic acid; 6-benzo[b][1,4]benzothiazepinamine IUPAC Name: acetic acid; benzo[b][1,4]benzothiazepin-6-amine Traditional Name: acetic acid; benzo[b][1,4]benzothiazepin-6-ylamine Formula: C15H14N2O2S MolecularWeight: 286.34886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10N2S.C2H4O2/c14-13-9-5-1-3-7-11(9)16-12-8-4-2-6-10(12)15-13;1-2(3)4/h1-8H,(H2,14,15);1H3,(H,3,4)