[5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-7-methyl-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-3-yl] ethanoate

Systemtic Name: [5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-7-methyl-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-3-yl] ethanoate Openeye Name: [5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-7-methyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate CAS Name: acetic acid [5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-7-methyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] ester IUPAC Name: [5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-7-methyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate Traditional Name: acetic acid [5-(2-dimethylaminoethyl)-4-keto-2-(4-methoxyphenyl)-7-methyl-2,3-dihydro-1,5-benzothiazepin-3-yl] ester Formula: C23H28N2O4S MolecularWeight: 428.54442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(C(C(=O)N2CCN(C)C)OC(=O)C)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC2=C(C=C1)SC(C(C(=O)N2CCN(C)C)OC(=O)C)C3=CC=C(C=C3)OC

InChI

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