3-bromanyl-5-(2-dimethylaminoethyl)-2-phenyl-1,5-benzothiazepin-4-one hydrochloride

Systemtic Name: 3-bromanyl-5-(2-dimethylaminoethyl)-2-phenyl-1,5-benzothiazepin-4-one hydrochloride Openeye Name: 3-bromo-5-(2-dimethylaminoethyl)-2-phenyl-1,5-benzothiazepin-4-one hydrochloride CAS Name: 3-bromo-5-(2-dimethylaminoethyl)-2-phenyl-1,5-benzothiazepin-4-one hydrochloride IUPAC Name: 3-bromo-5-(2-dimethylaminoethyl)-2-phenyl-1,5-benzothiazepin-4-one hydrochloride Traditional Name: 3-bromo-5-(2-dimethylaminoethyl)-2-phenyl-1,5-benzothiazepin-4-one hydrochloride Formula: C19H20BrClN2OS MolecularWeight: 439.7969

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C2=CC=CC=C2SC(=C(C1=O)Br)C3=CC=CC=C3.Cl

Isomeric SMILES

CN(C)CCN1C2=CC=CC=C2SC(=C(C1=O)Br)C3=CC=CC=C3.Cl

InChI

InChI=1S/C19H19BrN2OS.ClH/c1-21(2)12-13-22-15-10-6-7-11-16(15)24-18(17(20)19(22)23)14-8-4-3-5-9-14;/h3-11H,12-13H2,1-2H3;1H