3-(2,3-dihydro-1-benzofuran-5-ylmethylamino)-N-methyl-N-(1-pyridin-3-ylethyl)-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 3-(2,3-dihydro-1-benzofuran-5-ylmethylamino)-N-methyl-N-(1-pyridin-3-ylethyl)-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 3-(2,3-dihydrobenzofuran-5-ylmethylamino)-N-methyl-N-[1-(3-pyridyl)ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 3-(2,3-dihydrobenzofuran-5-ylmethylamino)-N-methyl-N-[1-(3-pyridinyl)ethyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 3-(2,3-dihydro-1-benzofuran-5-ylmethylamino)-N-methyl-N-(1-pyridin-3-ylethyl)-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 3-(coumaran-5-ylmethylamino)-N-methyl-N-[1-(3-pyridyl)ethyl]-5-pyrrolidinosulfonyl-benzamide Formula: C28H32N4O4S MolecularWeight: 520.64308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN=CC=C1)N(C)C(=O)C2=CC(=CC(=C2)S(=O)(=O)N3CCCC3)NCC4=CC5=C(C=C4)OCC5

Isomeric SMILES

CC(C1=CN=CC=C1)N(C)C(=O)C2=CC(=CC(=C2)S(=O)(=O)N3CCCC3)NCC4=CC5=C(C=C4)OCC5

InChI

InChI=1S/C28H32N4O4S/c1-20(23-6-5-10-29-19-23)31(2)28(33)24-15-25(17-26(16-24)37(34,35)32-11-3-4-12-32)30-18-21-7-8-27-22(14-21)9-13-36-27/h5-8,10,14-17,19-20,30H,3-4,9,11-13,18H2,1-2H3