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

Systemtic Name: 2-[2-(4-bromophenyl)sulfanylethanoyl-methyl-amino]-N-(4-morpholin-4-ylphenyl)ethanamide Openeye Name: 2-[[2-(4-bromophenyl)sulfanylacetyl]-methyl-amino]-N-(4-morpholinophenyl)acetamide CAS Name: 2-[[2-[(4-bromophenyl)thio]-1-oxoethyl]-methylamino]-N-[4-(4-morpholinyl)phenyl]acetamide IUPAC Name: 2-[[2-(4-bromophenyl)sulfanylacetyl]-methylamino]-N-(4-morpholin-4-ylphenyl)acetamide Traditional Name: 2-[[2-[(4-bromophenyl)thio]acetyl]-methyl-amino]-N-(4-morpholinophenyl)acetamide Formula: C21H24BrN3O3S MolecularWeight: 478.40256

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=C(C=C1)N2CCOCC2)C(=O)CSC3=CC=C(C=C3)Br

Isomeric SMILES

CN(CC(=O)NC1=CC=C(C=C1)N2CCOCC2)C(=O)CSC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H24BrN3O3S/c1-24(21(27)15-29-19-8-2-16(22)3-9-19)14-20(26)23-17-4-6-18(7-5-17)25-10-12-28-13-11-25/h2-9H,10-15H2,1H3,(H,23,26)