[(2R,3R)-5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-8-methyl-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-3-yl] ethyl carbonate

Systemtic Name: [(2R,3R)-5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-8-methyl-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-3-yl] ethyl carbonate Openeye Name: [(2R,3R)-5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-8-methyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] ethyl carbonate CAS Name: carbonic acid [(2R,3R)-5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-8-methyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] ethyl ester IUPAC Name: [(2R,3R)-5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-8-methyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] ethyl carbonate Traditional Name: carbonic acid [(2R,3R)-5-(2-dimethylaminoethyl)-4-keto-2-(4-methoxyphenyl)-8-methyl-2,3-dihydro-1,5-benzothiazepin-3-yl] ethyl ester Formula: C24H30N2O5S MolecularWeight: 458.5704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OC1C(SC2=C(C=CC(=C2)C)N(C1=O)CCN(C)C)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)O[C@H]1[C@H](SC2=C(C=CC(=C2)C)N(C1=O)CCN(C)C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H30N2O5S/c1-6-30-24(28)31-21-22(17-8-10-18(29-5)11-9-17)32-20-15-16(2)7-12-19(20)26(23(21)27)14-13-25(3)4/h7-12,15,21-22H,6,13-14H2,1-5H3/t21-,22+/m0/s1