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

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl-propyl-amino]propan-1-one Openeye Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl-propyl-amino]propan-1-one CAS Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl-propylamino]-1-propanone IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl-propylamino]propan-1-one Traditional Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-[homoveratryl(propyl)amino]propan-1-one Formula: C25H34N2O3S MolecularWeight: 442.61406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H34N2O3S/c1-4-14-26(16-12-20-10-11-22(29-2)23(19-20)30-3)17-13-25(28)27-15-7-18-31-24-9-6-5-8-21(24)27/h5-6,8-11,19H,4,7,12-18H2,1-3H3