ethanedioic acid; 5-oxidanylidene-N-[4-[3-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-1-benzothiophen-2-yl]phenyl]pyrrolidine-2-carboxamide

Systemtic Name: ethanedioic acid; 5-oxidanylidene-N-[4-[3-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-1-benzothiophen-2-yl]phenyl]pyrrolidine-2-carboxamide Openeye Name: oxalic acid; 5-oxo-N-[4-[3-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]benzothiophen-2-yl]phenyl]pyrrolidine-2-carboxamide CAS Name: oxalic acid; 5-oxo-N-[4-[3-[[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]methyl]-1-benzothiophen-2-yl]phenyl]-2-pyrrolidinecarboxamide IUPAC Name: oxalic acid; 5-oxo-N-[4-[3-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-1-benzothiophen-2-yl]phenyl]pyrrolidine-2-carboxamide Traditional Name: 5-keto-N-[4-[3-[4-(2-pyrrolidinoethoxy)benzyl]benzothiophen-2-yl]phenyl]pyrrolidine-2-carboxamide; oxalic acid Formula: C34H35N3O7S MolecularWeight: 629.7226

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC2=CC=C(C=C2)CC3=C(SC4=CC=CC=C43)C5=CC=C(C=C5)NC(=O)C6CCC(=O)N6.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(C1)CCOC2=CC=C(C=C2)CC3=C(SC4=CC=CC=C43)C5=CC=C(C=C5)NC(=O)C6CCC(=O)N6.C(=O)(C(=O)O)O

InChI

InChI=1S/C32H33N3O3S.C2H2O4/c36-30-16-15-28(34-30)32(37)33-24-11-9-23(10-12-24)31-27(26-5-1-2-6-29(26)39-31)21-22-7-13-25(14-8-22)38-20-19-35-17-3-4-18-35;3-1(4)2(5)6/h1-2,5-14,28H,3-4,15-21H2,(H,33,37)(H,34,36);(H,3,4)(H,5,6)