5-[[4-[3-[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]carbonyl-1-benzothiophen-2-yl]phenoxy]methyl]pyrrolidin-2-one

Systemtic Name: 5-[[4-[3-[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]carbonyl-1-benzothiophen-2-yl]phenoxy]methyl]pyrrolidin-2-one Openeye Name: 5-[[4-[3-[3-methoxy-4-(pyrrolidin-1-ylmethyl)benzoyl]benzothiophen-2-yl]phenoxy]methyl]pyrrolidin-2-one CAS Name: 5-[[4-[3-[[3-methoxy-4-(1-pyrrolidinylmethyl)phenyl]-oxomethyl]-1-benzothiophen-2-yl]phenoxy]methyl]-2-pyrrolidinone IUPAC Name: 5-[[4-[3-[3-methoxy-4-(pyrrolidin-1-ylmethyl)benzoyl]-1-benzothiophen-2-yl]phenoxy]methyl]pyrrolidin-2-one Traditional Name: 5-[[4-[3-[3-methoxy-4-(pyrrolidinomethyl)benzoyl]benzothiophen-2-yl]phenoxy]methyl]-2-pyrrolidone Formula: C32H32N2O4S MolecularWeight: 540.67248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)C2=C(SC3=CC=CC=C32)C4=CC=C(C=C4)OCC5CCC(=O)N5)CN6CCCC6

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)C2=C(SC3=CC=CC=C32)C4=CC=C(C=C4)OCC5CCC(=O)N5)CN6CCCC6

InChI

InChI=1S/C32H32N2O4S/c1-37-27-18-22(8-9-23(27)19-34-16-4-5-17-34)31(36)30-26-6-2-3-7-28(26)39-32(30)21-10-13-25(14-11-21)38-20-24-12-15-29(35)33-24/h2-3,6-11,13-14,18,24H,4-5,12,15-17,19-20H2,1H3,(H,33,35)