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

Systemtic Name: 2-[(3-chloranyl-4-fluoranyl-phenyl)-methylsulfonyl-amino]-N-[(4-methylphenyl)-phenyl-methyl]ethanamide Openeye Name: 2-(3-chloro-4-fluoro-N-methylsulfonyl-anilino)-N-[phenyl(p-tolyl)methyl]acetamide CAS Name: 2-(3-chloro-4-fluoro-N-methylsulfonylanilino)-N-[(4-methylphenyl)-phenylmethyl]acetamide IUPAC Name: 2-(3-chloro-4-fluoro-N-methylsulfonylanilino)-N-[(4-methylphenyl)-phenylmethyl]acetamide Traditional Name: 2-(3-chloro-4-fluoro-N-mesyl-anilino)-N-[phenyl(p-tolyl)methyl]acetamide Formula: C23H22ClFN2O3S MolecularWeight: 460.948783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)CN(C3=CC(=C(C=C3)F)Cl)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)CN(C3=CC(=C(C=C3)F)Cl)S(=O)(=O)C

InChI

InChI=1S/C23H22ClFN2O3S/c1-16-8-10-18(11-9-16)23(17-6-4-3-5-7-17)26-22(28)15-27(31(2,29)30)19-12-13-21(25)20(24)14-19/h3-14,23H,15H2,1-2H3,(H,26,28)