4-[(4-fluorophenyl)-methylsulfonyl-amino]-N-(phenylmethyl)butanamide

Systemtic Name: 4-[(4-fluorophenyl)-methylsulfonyl-amino]-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-4-(4-fluoro-N-methylsulfonyl-anilino)butanamide CAS Name: 4-(4-fluoro-N-methylsulfonylanilino)-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-4-(4-fluoro-N-methylsulfonylanilino)butanamide Traditional Name: N-benzyl-4-(4-fluoro-N-mesyl-anilino)butyramide Formula: C18H21FN2O3S MolecularWeight: 364.434343

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCC(=O)NCC1=CC=CC=C1)C2=CC=C(C=C2)F

Isomeric SMILES

CS(=O)(=O)N(CCCC(=O)NCC1=CC=CC=C1)C2=CC=C(C=C2)F

InChI

InChI=1S/C18H21FN2O3S/c1-25(23,24)21(17-11-9-16(19)10-12-17)13-5-8-18(22)20-14-15-6-3-2-4-7-15/h2-4,6-7,9-12H,5,8,13-14H2,1H3,(H,20,22)