3-[3-[2-(6-methoxy-1-benzothiophen-3-yl)ethyl-methyl-amino]propyl]-7,8-dimethyl-1,2-dihydro-3-benzazepine-4,5-dione

Systemtic Name: 3-[3-[2-(6-methoxy-1-benzothiophen-3-yl)ethyl-methyl-amino]propyl]-7,8-dimethyl-1,2-dihydro-3-benzazepine-4,5-dione Openeye Name: 3-[3-[2-(6-methoxybenzothiophen-3-yl)ethyl-methyl-amino]propyl]-7,8-dimethyl-1,2-dihydro-3-benzazepine-4,5-dione CAS Name: 3-[3-[2-(6-methoxy-1-benzothiophen-3-yl)ethyl-methylamino]propyl]-7,8-dimethyl-1,2-dihydro-3-benzazepine-4,5-dione IUPAC Name: 3-[3-[2-(6-methoxy-1-benzothiophen-3-yl)ethyl-methylamino]propyl]-7,8-dimethyl-1,2-dihydro-3-benzazepine-4,5-dione Traditional Name: 3-[3-[2-(6-methoxybenzothiophen-3-yl)ethyl-methyl-amino]propyl]-7,8-dimethyl-1,2-dihydro-3-benzazepine-4,5-quinone Formula: C27H32N2O3S MolecularWeight: 464.61958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)CCN(C(=O)C2=O)CCCN(C)CCC3=CSC4=C3C=CC(=C4)OC)C

Isomeric SMILES

CC1=C(C=C2C(=C1)CCN(C(=O)C2=O)CCCN(C)CCC3=CSC4=C3C=CC(=C4)OC)C

InChI

InChI=1S/C27H32N2O3S/c1-18-14-20-9-13-29(27(31)26(30)24(20)15-19(18)2)11-5-10-28(3)12-8-21-17-33-25-16-22(32-4)6-7-23(21)25/h6-7,14-17H,5,8-13H2,1-4H3