[5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-8-methyl-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-3-yl] ethanoate hydrobromide

Systemtic Name: [5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-8-methyl-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-3-yl] ethanoate hydrobromide Openeye Name: [5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-8-methyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate hydrobromide CAS Name: acetic acid [5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-8-methyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] ester hydrobromide IUPAC Name: [5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-8-methyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate hydrobromide Traditional Name: acetic acid [5-(2-dimethylaminoethyl)-4-keto-2-(4-methoxyphenyl)-8-methyl-2,3-dihydro-1,5-benzothiazepin-3-yl] ester hydrobromide Formula: C23H29BrN2O4S MolecularWeight: 509.45636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C(C(S2)C3=CC=C(C=C3)OC)OC(=O)C)CCN(C)C.Br

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)C(C(S2)C3=CC=C(C=C3)OC)OC(=O)C)CCN(C)C.Br

InChI

InChI=1S/C23H28N2O4S.BrH/c1-15-6-11-19-20(14-15)30-22(17-7-9-18(28-5)10-8-17)21(29-16(2)26)23(27)25(19)13-12-24(3)4;/h6-11,14,21-22H,12-13H2,1-5H3;1H