2-[(4-bromophenyl)-methylsulfonyl-amino]-N-[(4-morpholin-4-ylphenyl)methyl]ethanamide

Systemtic Name: 2-[(4-bromophenyl)-methylsulfonyl-amino]-N-[(4-morpholin-4-ylphenyl)methyl]ethanamide Openeye Name: 2-(4-bromo-N-methylsulfonyl-anilino)-N-[(4-morpholinophenyl)methyl]acetamide CAS Name: 2-(4-bromo-N-methylsulfonylanilino)-N-[[4-(4-morpholinyl)phenyl]methyl]acetamide IUPAC Name: 2-(4-bromo-N-methylsulfonylanilino)-N-[(4-morpholin-4-ylphenyl)methyl]acetamide Traditional Name: 2-(4-bromo-N-mesyl-anilino)-N-(4-morpholinobenzyl)acetamide Formula: C20H24BrN3O4S MolecularWeight: 482.39126

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCC1=CC=C(C=C1)N2CCOCC2)C3=CC=C(C=C3)Br

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCC1=CC=C(C=C1)N2CCOCC2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H24BrN3O4S/c1-29(26,27)24(19-8-4-17(21)5-9-19)15-20(25)22-14-16-2-6-18(7-3-16)23-10-12-28-13-11-23/h2-9H,10-15H2,1H3,(H,22,25)