2-[2-[(4-fluorophenyl)-methylsulfonyl-amino]butanoylamino]-N-(2-methoxyethyl)benzamide

Systemtic Name: 2-[2-[(4-fluorophenyl)-methylsulfonyl-amino]butanoylamino]-N-(2-methoxyethyl)benzamide Openeye Name: 2-[2-(4-fluoro-N-methylsulfonyl-anilino)butanoylamino]-N-(2-methoxyethyl)benzamide CAS Name: 2-[[2-(4-fluoro-N-methylsulfonylanilino)-1-oxobutyl]amino]-N-(2-methoxyethyl)benzamide IUPAC Name: 2-[2-(4-fluoro-N-methylsulfonylanilino)butanoylamino]-N-(2-methoxyethyl)benzamide Traditional Name: 2-[2-(4-fluoro-N-mesyl-anilino)butanoylamino]-N-(2-methoxyethyl)benzamide Formula: C21H26FN3O5S MolecularWeight: 451.511643

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C(=O)NCCOC)N(C2=CC=C(C=C2)F)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C(=O)NCCOC)N(C2=CC=C(C=C2)F)S(=O)(=O)C

InChI

InChI=1S/C21H26FN3O5S/c1-4-19(25(31(3,28)29)16-11-9-15(22)10-12-16)21(27)24-18-8-6-5-7-17(18)20(26)23-13-14-30-2/h5-12,19H,4,13-14H2,1-3H3,(H,23,26)(H,24,27)