3-[3-[2-(1-benzothiophen-3-yl)ethyl-methyl-amino]propyl]-8-methoxy-2,5-dihydro-1H-3-benzazepin-4-one

Systemtic Name: 3-[3-[2-(1-benzothiophen-3-yl)ethyl-methyl-amino]propyl]-8-methoxy-2,5-dihydro-1H-3-benzazepin-4-one Openeye Name: 3-[3-[2-(benzothiophen-3-yl)ethyl-methyl-amino]propyl]-8-methoxy-2,5-dihydro-1H-3-benzazepin-4-one CAS Name: 3-[3-[2-(1-benzothiophen-3-yl)ethyl-methylamino]propyl]-8-methoxy-2,5-dihydro-1H-3-benzazepin-4-one IUPAC Name: 3-[3-[2-(1-benzothiophen-3-yl)ethyl-methylamino]propyl]-8-methoxy-2,5-dihydro-1H-3-benzazepin-4-one Traditional Name: 3-[3-[2-(benzothiophen-3-yl)ethyl-methyl-amino]propyl]-8-methoxy-2,5-dihydro-1H-3-benzazepin-4-one Formula: C25H30N2O2S MolecularWeight: 422.5829

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCN1CCC2=C(CC1=O)C=CC(=C2)OC)CCC3=CSC4=CC=CC=C43

Isomeric SMILES

CN(CCCN1CCC2=C(CC1=O)C=CC(=C2)OC)CCC3=CSC4=CC=CC=C43

InChI

InChI=1S/C25H30N2O2S/c1-26(14-10-21-18-30-24-7-4-3-6-23(21)24)12-5-13-27-15-11-20-16-22(29-2)9-8-19(20)17-25(27)28/h3-4,6-9,16,18H,5,10-15,17H2,1-2H3