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

Systemtic Name: 3-[3-[3-(3,4-dimethoxyphenyl)sulfinylpropyl-methyl-amino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Openeye Name: 3-[3-[3-(3,4-dimethoxyphenyl)sulfinylpropyl-methyl-amino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one CAS Name: 3-[3-[3-(3,4-dimethoxyphenyl)sulfinylpropyl-methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one IUPAC Name: 3-[3-[3-(3,4-dimethoxyphenyl)sulfinylpropyl-methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Traditional Name: 3-[3-[3-(3,4-dimethoxyphenyl)sulfinylpropyl-methyl-amino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Formula: C27H38N2O6S MolecularWeight: 518.66542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H38N2O6S/c1-28(12-7-15-36(31)22-8-9-23(32-2)26(19-22)35-5)11-6-13-29-14-10-20-16-24(33-3)25(34-4)17-21(20)18-27(29)30/h8-9,16-17,19H,6-7,10-15,18H2,1-5H3