2-bromanyl-N-[4-methylsulfanyl-1-oxidanylidene-1-(pentylamino)butan-2-yl]benzamide

Systemtic Name: 2-bromanyl-N-[4-methylsulfanyl-1-oxidanylidene-1-(pentylamino)butan-2-yl]benzamide Openeye Name: 2-bromo-N-[3-methylsulfanyl-1-(pentylcarbamoyl)propyl]benzamide CAS Name: 2-bromo-N-[4-(methylthio)-1-oxo-1-(pentylamino)butan-2-yl]benzamide IUPAC Name: 2-bromo-N-[4-methylsulfanyl-1-oxo-1-(pentylamino)butan-2-yl]benzamide Traditional Name: N-[1-(amylcarbamoyl)-3-(methylthio)propyl]-2-bromo-benzamide Formula: C17H25BrN2O2S MolecularWeight: 401.3616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C(CCSC)NC(=O)C1=CC=CC=C1Br

Isomeric SMILES

CCCCCNC(=O)C(CCSC)NC(=O)C1=CC=CC=C1Br

InChI

InChI=1S/C17H25BrN2O2S/c1-3-4-7-11-19-17(22)15(10-12-23-2)20-16(21)13-8-5-6-9-14(13)18/h5-6,8-9,15H,3-4,7,10-12H2,1-2H3,(H,19,22)(H,20,21)