[5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-6,7-dimethyl-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-3-yl] ethanoate

Systemtic Name: [5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-6,7-dimethyl-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-3-yl] ethanoate Openeye Name: [5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-6,7-dimethyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate CAS Name: acetic acid [5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-6,7-dimethyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] ester IUPAC Name: [5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-6,7-dimethyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate Traditional Name: acetic acid [5-(2-dimethylaminoethyl)-4-keto-2-(4-methoxyphenyl)-6,7-dimethyl-2,3-dihydro-1,5-benzothiazepin-3-yl] ester Formula: C24H30N2O4S MolecularWeight: 442.571

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)SC(C(C(=O)N2CCN(C)C)OC(=O)C)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=C(C2=C(C=C1)SC(C(C(=O)N2CCN(C)C)OC(=O)C)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C24H30N2O4S/c1-15-7-12-20-21(16(15)2)26(14-13-25(4)5)24(28)22(30-17(3)27)23(31-20)18-8-10-19(29-6)11-9-18/h7-12,22-23H,13-14H2,1-6H3