4-[[anthracen-9-yl-(4-chlorophenyl)sulfanyl-methyl]amino]-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide

Systemtic Name: 4-[[anthracen-9-yl-(4-chlorophenyl)sulfanyl-methyl]amino]-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide Openeye Name: 4-[[9-anthryl-(4-chlorophenyl)sulfanyl-methyl]amino]-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide CAS Name: 4-[[9-anthracenyl-[(4-chlorophenyl)thio]methyl]amino]-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[[anthracen-9-yl-(4-chlorophenyl)sulfanylmethyl]amino]-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide Traditional Name: 4-[[9-anthryl-[(4-chlorophenyl)thio]methyl]amino]-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide Formula: C33H27ClN4O2S2 MolecularWeight: 611.17608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(C3=C4C=CC=CC4=CC5=CC=CC=C53)SC6=CC=C(C=C6)Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(C3=C4C=CC=CC4=CC5=CC=CC=C53)SC6=CC=C(C=C6)Cl)C

InChI

InChI=1S/C33H27ClN4O2S2/c1-21-19-22(2)36-33(35-21)38-42(39,40)28-17-13-26(14-18-28)37-32(41-27-15-11-25(34)12-16-27)31-29-9-5-3-7-23(29)20-24-8-4-6-10-30(24)31/h3-20,32,37H,1-2H3,(H,35,36,38)