4-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]-N-[(4-fluorophenyl)methyl]butanamide

Systemtic Name: 4-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]-N-[(4-fluorophenyl)methyl]butanamide Openeye Name: 4-(5-chloro-2-methyl-N-methylsulfonyl-anilino)-N-[(4-fluorophenyl)methyl]butanamide CAS Name: 4-(5-chloro-2-methyl-N-methylsulfonylanilino)-N-[(4-fluorophenyl)methyl]butanamide IUPAC Name: 4-(5-chloro-2-methyl-N-methylsulfonylanilino)-N-[(4-fluorophenyl)methyl]butanamide Traditional Name: 4-(5-chloro-N-mesyl-2-methyl-anilino)-N-(4-fluorobenzyl)butyramide Formula: C19H22ClFN2O3S MolecularWeight: 412.905983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N(CCCC(=O)NCC2=CC=C(C=C2)F)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N(CCCC(=O)NCC2=CC=C(C=C2)F)S(=O)(=O)C

InChI

InChI=1S/C19H22ClFN2O3S/c1-14-5-8-16(20)12-18(14)23(27(2,25)26)11-3-4-19(24)22-13-15-6-9-17(21)10-7-15/h5-10,12H,3-4,11,13H2,1-2H3,(H,22,24)