2-(4-bromanyl-2-methyl-phenyl)sulfanyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]ethanamide

Systemtic Name: 2-(4-bromanyl-2-methyl-phenyl)sulfanyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]ethanamide Openeye Name: 2-(4-bromo-2-methyl-phenyl)sulfanyl-N-[(2-morpholinosulfonylphenyl)methyl]acetamide CAS Name: 2-[(4-bromo-2-methylphenyl)thio]-N-[[2-(4-morpholinylsulfonyl)phenyl]methyl]acetamide IUPAC Name: 2-(4-bromo-2-methylphenyl)sulfanyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]acetamide Traditional Name: 2-[(4-bromo-2-methyl-phenyl)thio]-N-(2-morpholinosulfonylbenzyl)acetamide Formula: C20H23BrN2O4S2 MolecularWeight: 499.44162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)SCC(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)SCC(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H23BrN2O4S2/c1-15-12-17(21)6-7-18(15)28-14-20(24)22-13-16-4-2-3-5-19(16)29(25,26)23-8-10-27-11-9-23/h2-7,12H,8-11,13-14H2,1H3,(H,22,24)