2-bromanyl-N-[4-methylsulfanyl-1-oxidanylidene-1-[(3-propan-2-ylphenyl)amino]butan-2-yl]benzamide

Systemtic Name: 2-bromanyl-N-[4-methylsulfanyl-1-oxidanylidene-1-[(3-propan-2-ylphenyl)amino]butan-2-yl]benzamide Openeye Name: 2-bromo-N-[1-[(3-isopropylphenyl)carbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: 2-bromo-N-[4-(methylthio)-1-oxo-1-(3-propan-2-ylanilino)butan-2-yl]benzamide IUPAC Name: 2-bromo-N-[4-methylsulfanyl-1-oxo-1-(3-propan-2-ylanilino)butan-2-yl]benzamide Traditional Name: 2-bromo-N-[1-(m-cumenylcarbamoyl)-3-(methylthio)propyl]benzamide Formula: C21H25BrN2O2S MolecularWeight: 449.4044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)NC(=O)C(CCSC)NC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CC(C)C1=CC(=CC=C1)NC(=O)C(CCSC)NC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C21H25BrN2O2S/c1-14(2)15-7-6-8-16(13-15)23-21(26)19(11-12-27-3)24-20(25)17-9-4-5-10-18(17)22/h4-10,13-14,19H,11-12H2,1-3H3,(H,23,26)(H,24,25)