1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl-ethyl-amino]propan-1-one

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl-ethyl-amino]propan-1-one Openeye Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl-ethyl-amino]propan-1-one CAS Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl-ethylamino]-1-propanone IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl-ethylamino]propan-1-one Traditional Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-[ethyl(homoveratryl)amino]propan-1-one Formula: C24H32N2O3S MolecularWeight: 428.58748

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC1=CC(=C(C=C1)OC)OC)CCC(=O)N2CCCSC3=CC=CC=C32

Isomeric SMILES

CCN(CCC1=CC(=C(C=C1)OC)OC)CCC(=O)N2CCCSC3=CC=CC=C32

InChI

InChI=1S/C24H32N2O3S/c1-4-25(15-12-19-10-11-21(28-2)22(18-19)29-3)16-13-24(27)26-14-7-17-30-23-9-6-5-8-20(23)26/h5-6,8-11,18H,4,7,12-17H2,1-3H3