3-azanyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one hydrobromide

Systemtic Name: 3-azanyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one hydrobromide Openeye Name: 3-amino-3,5-dihydro-2H-1,5-benzothiazepin-4-one hydrobromide CAS Name: 3-amino-3,5-dihydro-2H-1,5-benzothiazepin-4-one hydrobromide IUPAC Name: 3-amino-3,5-dihydro-2H-1,5-benzothiazepin-4-one hydrobromide Traditional Name: 3-amino-3,5-dihydro-2H-1,5-benzothiazepin-4-one hydrobromide Formula: C9H11BrN2OS MolecularWeight: 275.16544

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)NC2=CC=CC=C2S1)N.Br

Isomeric SMILES

C1C(C(=O)NC2=CC=CC=C2S1)N.Br

InChI

InChI=1S/C9H10N2OS.BrH/c10-6-5-13-8-4-2-1-3-7(8)11-9(6)12;/h1-4,6H,5,10H2,(H,11,12);1H