N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-ethyl-N-[2-[(4-fluorobenzyl)amino]-2-keto-ethyl]-3-pyrrolidinosulfonyl-benzamide Formula: C22H26FN3O4S MolecularWeight: 447.522943

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NCC1=CC=C(C=C1)F)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCN(CC(=O)NCC1=CC=C(C=C1)F)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C22H26FN3O4S/c1-2-25(16-21(27)24-15-17-8-10-19(23)11-9-17)22(28)18-6-5-7-20(14-18)31(29,30)26-12-3-4-13-26/h5-11,14H,2-4,12-13,15-16H2,1H3,(H,24,27)