N-[2-[(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]ethyl]-3-fluoranyl-4-methyl-benzamide

Systemtic Name: N-[2-[(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]ethyl]-3-fluoranyl-4-methyl-benzamide Openeye Name: N-[2-[(2-chloro-5-pyrrolidin-1-ylsulfonyl-benzoyl)amino]ethyl]-3-fluoro-4-methyl-benzamide CAS Name: N-[2-[[[2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]amino]ethyl]-3-fluoro-4-methylbenzamide IUPAC Name: N-[2-[(2-chloro-5-pyrrolidin-1-ylsulfonylbenzoyl)amino]ethyl]-3-fluoro-4-methylbenzamide Traditional Name: N-[2-[(2-chloro-5-pyrrolidinosulfonyl-benzoyl)amino]ethyl]-3-fluoro-4-methyl-benzamide Formula: C21H23ClFN3O4S MolecularWeight: 467.941423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl)F

InChI

InChI=1S/C21H23ClFN3O4S/c1-14-4-5-15(12-19(14)23)20(27)24-8-9-25-21(28)17-13-16(6-7-18(17)22)31(29,30)26-10-2-3-11-26/h4-7,12-13H,2-3,8-11H2,1H3,(H,24,27)(H,25,28)