2-[(4-fluorophenyl)-methylsulfonyl-amino]-N-[(4-imidazol-1-ylphenyl)methyl]propanamide

Systemtic Name: 2-[(4-fluorophenyl)-methylsulfonyl-amino]-N-[(4-imidazol-1-ylphenyl)methyl]propanamide Openeye Name: 2-(4-fluoro-N-methylsulfonyl-anilino)-N-[(4-imidazol-1-ylphenyl)methyl]propanamide CAS Name: 2-(4-fluoro-N-methylsulfonylanilino)-N-[[4-(1-imidazolyl)phenyl]methyl]propanamide IUPAC Name: 2-(4-fluoro-N-methylsulfonylanilino)-N-[(4-imidazol-1-ylphenyl)methyl]propanamide Traditional Name: 2-(4-fluoro-N-mesyl-anilino)-N-(4-imidazol-1-ylbenzyl)propionamide Formula: C20H21FN4O3S MolecularWeight: 416.469143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)N2C=CN=C2)N(C3=CC=C(C=C3)F)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)NCC1=CC=C(C=C1)N2C=CN=C2)N(C3=CC=C(C=C3)F)S(=O)(=O)C

InChI

InChI=1S/C20H21FN4O3S/c1-15(25(29(2,27)28)19-9-5-17(21)6-10-19)20(26)23-13-16-3-7-18(8-4-16)24-12-11-22-14-24/h3-12,14-15H,13H2,1-2H3,(H,23,26)