N-[4-[[2-butyl-5-(methylsulfonylamino)-1-benzofuran-3-yl]carbonyl]phenyl]-3-(dibutylamino)propanamide; ethanedioic acid

Systemtic Name: N-[4-[[2-butyl-5-(methylsulfonylamino)-1-benzofuran-3-yl]carbonyl]phenyl]-3-(dibutylamino)propanamide; ethanedioic acid Openeye Name: N-[4-[2-butyl-5-(methanesulfonamido)benzofuran-3-carbonyl]phenyl]-3-(dibutylamino)propanamide; oxalic acid CAS Name: N-[4-[[2-butyl-5-(methanesulfonamido)-3-benzofuranyl]-oxomethyl]phenyl]-3-(dibutylamino)propanamide; oxalic acid IUPAC Name: N-[4-[2-butyl-5-(methanesulfonamido)-1-benzofuran-3-carbonyl]phenyl]-3-(dibutylamino)propanamide; oxalic acid Traditional Name: N-[4-[2-butyl-5-(methanesulfonamido)benzofuran-3-carbonyl]phenyl]-3-(dibutylamino)propionamide; oxalic acid Formula: C33H45N3O9S MolecularWeight: 659.7901

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(O1)C=CC(=C2)NS(=O)(=O)C)C(=O)C3=CC=C(C=C3)NC(=O)CCN(CCCC)CCCC.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCC1=C(C2=C(O1)C=CC(=C2)NS(=O)(=O)C)C(=O)C3=CC=C(C=C3)NC(=O)CCN(CCCC)CCCC.C(=O)(C(=O)O)O

InChI

InChI=1S/C31H43N3O5S.C2H2O4/c1-5-8-11-28-30(26-22-25(33-40(4,37)38)16-17-27(26)39-28)31(36)23-12-14-24(15-13-23)32-29(35)18-21-34(19-9-6-2)20-10-7-3;3-1(4)2(5)6/h12-17,22,33H,5-11,18-21H2,1-4H3,(H,32,35);(H,3,4)(H,5,6)