4-[(4-fluorophenyl)-methylsulfonyl-amino]-N-[(4-propan-2-yloxyphenyl)methyl]butanamide

Systemtic Name: 4-[(4-fluorophenyl)-methylsulfonyl-amino]-N-[(4-propan-2-yloxyphenyl)methyl]butanamide Openeye Name: 4-(4-fluoro-N-methylsulfonyl-anilino)-N-[(4-isopropoxyphenyl)methyl]butanamide CAS Name: 4-(4-fluoro-N-methylsulfonylanilino)-N-[(4-propan-2-yloxyphenyl)methyl]butanamide IUPAC Name: 4-(4-fluoro-N-methylsulfonylanilino)-N-[(4-propan-2-yloxyphenyl)methyl]butanamide Traditional Name: 4-(4-fluoro-N-mesyl-anilino)-N-(4-isopropoxybenzyl)butyramide Formula: C21H27FN2O4S MolecularWeight: 422.513483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CNC(=O)CCCN(C2=CC=C(C=C2)F)S(=O)(=O)C

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CNC(=O)CCCN(C2=CC=C(C=C2)F)S(=O)(=O)C

InChI

InChI=1S/C21H27FN2O4S/c1-16(2)28-20-12-6-17(7-13-20)15-23-21(25)5-4-14-24(29(3,26)27)19-10-8-18(22)9-11-19/h6-13,16H,4-5,14-15H2,1-3H3,(H,23,25)