2-bromanyl-N-[1-[(2-methyl-2-morpholin-4-yl-butyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-bromanyl-N-[1-[(2-methyl-2-morpholin-4-yl-butyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-bromo-N-[1-[(2-methyl-2-morpholino-butyl)carbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: 2-bromo-N-[1-[[2-methyl-2-(4-morpholinyl)butyl]amino]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: 2-bromo-N-[1-[(2-methyl-2-morpholin-4-ylbutyl)amino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-bromo-N-[1-[(2-methyl-2-morpholino-butyl)carbamoyl]-3-(methylthio)propyl]benzamide Formula: C21H32BrN3O3S MolecularWeight: 486.46608

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CNC(=O)C(CCSC)NC(=O)C1=CC=CC=C1Br)N2CCOCC2

Isomeric SMILES

CCC(C)(CNC(=O)C(CCSC)NC(=O)C1=CC=CC=C1Br)N2CCOCC2

InChI

InChI=1S/C21H32BrN3O3S/c1-4-21(2,25-10-12-28-13-11-25)15-23-20(27)18(9-14-29-3)24-19(26)16-7-5-6-8-17(16)22/h5-8,18H,4,9-15H2,1-3H3,(H,23,27)(H,24,26)