(2R,3R)-5-(2-dimethylaminoethyl)-6-methoxy-2-(4-methoxyphenyl)-3-oxidanyl-2,3-dihydro-1,5-benzothiazepin-4-one

Systemtic Name: (2R,3R)-5-(2-dimethylaminoethyl)-6-methoxy-2-(4-methoxyphenyl)-3-oxidanyl-2,3-dihydro-1,5-benzothiazepin-4-one Openeye Name: (2R,3R)-5-(2-dimethylaminoethyl)-3-hydroxy-6-methoxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one CAS Name: (2R,3R)-5-(2-dimethylaminoethyl)-3-hydroxy-6-methoxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one IUPAC Name: (2R,3R)-5-(2-dimethylaminoethyl)-3-hydroxy-6-methoxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one Traditional Name: (2R,3R)-5-(2-dimethylaminoethyl)-3-hydroxy-6-methoxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C(=O)C(C(SC2=CC=CC(=C21)OC)C3=CC=C(C=C3)OC)O

Isomeric SMILES

CN(C)CCN1C(=O)[C@H]([C@H](SC2=CC=CC(=C21)OC)C3=CC=C(C=C3)OC)O

InChI

InChI=1S/C21H26N2O4S/c1-22(2)12-13-23-18-16(27-4)6-5-7-17(18)28-20(19(24)21(23)25)14-8-10-15(26-3)11-9-14/h5-11,19-20,24H,12-13H2,1-4H3/t19-,20+/m0/s1