2-[(3-chloranyl-4-fluoranyl-phenyl)-methylsulfonyl-amino]-N-[(2-imidazol-1-ylphenyl)methyl]ethanamide

Systemtic Name: 2-[(3-chloranyl-4-fluoranyl-phenyl)-methylsulfonyl-amino]-N-[(2-imidazol-1-ylphenyl)methyl]ethanamide Openeye Name: 2-(3-chloro-4-fluoro-N-methylsulfonyl-anilino)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide CAS Name: 2-(3-chloro-4-fluoro-N-methylsulfonylanilino)-N-[[2-(1-imidazolyl)phenyl]methyl]acetamide IUPAC Name: 2-(3-chloro-4-fluoro-N-methylsulfonylanilino)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide Traditional Name: 2-(3-chloro-4-fluoro-N-mesyl-anilino)-N-(2-imidazol-1-ylbenzyl)acetamide Formula: C19H18ClFN4O3S MolecularWeight: 436.887623

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCC1=CC=CC=C1N2C=CN=C2)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCC1=CC=CC=C1N2C=CN=C2)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C19H18ClFN4O3S/c1-29(27,28)25(15-6-7-17(21)16(20)10-15)12-19(26)23-11-14-4-2-3-5-18(14)24-9-8-22-13-24/h2-10,13H,11-12H2,1H3,(H,23,26)