2-chloranyl-N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[2-(2-furylmethylamino)-2-oxo-ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-chloro-N-[2-(2-furanylmethylamino)-2-oxoethyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[2-(2-furfurylamino)-2-keto-ethyl]-5-pyrrolidinosulfonyl-benzamide Formula: C18H20ClN3O5S MolecularWeight: 425.8865

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCC(=O)NCC3=CC=CO3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCC(=O)NCC3=CC=CO3

InChI

InChI=1S/C18H20ClN3O5S/c19-16-6-5-14(28(25,26)22-7-1-2-8-22)10-15(16)18(24)21-12-17(23)20-11-13-4-3-9-27-13/h3-6,9-10H,1-2,7-8,11-12H2,(H,20,23)(H,21,24)