2-bromanyl-N-[1-[[3-(dimethylcarbamoyl)phenyl]methylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-bromanyl-N-[1-[[3-(dimethylcarbamoyl)phenyl]methylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-bromo-N-[1-[[3-(dimethylcarbamoyl)phenyl]methylcarbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: 2-bromo-N-[1-[[3-[dimethylamino(oxo)methyl]phenyl]methylamino]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: 2-bromo-N-[1-[[3-(dimethylcarbamoyl)phenyl]methylamino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-bromo-N-[1-[[3-(dimethylcarbamoyl)benzyl]carbamoyl]-3-(methylthio)propyl]benzamide Formula: C22H26BrN3O3S MolecularWeight: 492.42914

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26BrN3O3S/c1-26(2)22(29)16-8-6-7-15(13-16)14-24-21(28)19(11-12-30-3)25-20(27)17-9-4-5-10-18(17)23/h4-10,13,19H,11-12,14H2,1-3H3,(H,24,28)(H,25,27)