5-(2-dimethylaminoethyl)-8-fluoranyl-2-(4-methoxyphenyl)-3-oxidanyl-2,3-dihydro-1,5-benzothiazepin-4-one hydrochloride

Systemtic Name: 5-(2-dimethylaminoethyl)-8-fluoranyl-2-(4-methoxyphenyl)-3-oxidanyl-2,3-dihydro-1,5-benzothiazepin-4-one hydrochloride Openeye Name: 5-(2-dimethylaminoethyl)-8-fluoro-3-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one hydrochloride CAS Name: 5-(2-dimethylaminoethyl)-8-fluoro-3-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one hydrochloride IUPAC Name: 5-(2-dimethylaminoethyl)-8-fluoro-3-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one hydrochloride Traditional Name: 5-(2-dimethylaminoethyl)-8-fluoro-3-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one hydrochloride Formula: C20H24ClFN2O3S MolecularWeight: 426.932563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C2=C(C=C(C=C2)F)SC(C(C1=O)O)C3=CC=C(C=C3)OC.Cl

Isomeric SMILES

CN(C)CCN1C2=C(C=C(C=C2)F)SC(C(C1=O)O)C3=CC=C(C=C3)OC.Cl

InChI

InChI=1S/C20H23FN2O3S.ClH/c1-22(2)10-11-23-16-9-6-14(21)12-17(16)27-19(18(24)20(23)25)13-4-7-15(26-3)8-5-13;/h4-9,12,18-19,24H,10-11H2,1-3H3;1H