3-(furan-2-ylmethylamino)-N-(2-imidazol-1-ylethyl)-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 3-(furan-2-ylmethylamino)-N-(2-imidazol-1-ylethyl)-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 3-(2-furylmethylamino)-N-(2-imidazol-1-ylethyl)-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 3-(2-furanylmethylamino)-N-[2-(1-imidazolyl)ethyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 3-(furan-2-ylmethylamino)-N-(2-imidazol-1-ylethyl)-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 3-(2-furfurylamino)-N-(2-imidazol-1-ylethyl)-5-pyrrolidinosulfonyl-benzamide Formula: C21H25N5O4S MolecularWeight: 443.5193

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=CC(=C2)NCC3=CC=CO3)C(=O)NCCN4C=CN=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=CC(=C2)NCC3=CC=CO3)C(=O)NCCN4C=CN=C4

InChI

InChI=1S/C21H25N5O4S/c27-21(23-6-10-25-9-5-22-16-25)17-12-18(24-15-19-4-3-11-30-19)14-20(13-17)31(28,29)26-7-1-2-8-26/h3-5,9,11-14,16,24H,1-2,6-8,10,15H2,(H,23,27)