3-[3-[2-(3,4-dimethoxyphenyl)sulfanylethyl-methyl-amino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one

Systemtic Name: 3-[3-[2-(3,4-dimethoxyphenyl)sulfanylethyl-methyl-amino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Openeye Name: 3-[3-[2-(3,4-dimethoxyphenyl)sulfanylethyl-methyl-amino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one CAS Name: 3-[3-[2-[(3,4-dimethoxyphenyl)thio]ethyl-methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one IUPAC Name: 3-[3-[2-(3,4-dimethoxyphenyl)sulfanylethyl-methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Traditional Name: 3-[3-[2-[(3,4-dimethoxyphenyl)thio]ethyl-methyl-amino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Formula: C26H36N2O5S MolecularWeight: 488.63944

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCN1CCC2=CC(=C(C=C2CC1=O)OC)OC)CCSC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN(CCCN1CCC2=CC(=C(C=C2CC1=O)OC)OC)CCSC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C26H36N2O5S/c1-27(13-14-34-21-7-8-22(30-2)25(18-21)33-5)10-6-11-28-12-9-19-15-23(31-3)24(32-4)16-20(19)17-26(28)29/h7-8,15-16,18H,6,9-14,17H2,1-5H3