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

Systemtic Name: N-[1-[(3-acetamidophenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-bromanyl-benzamide Openeye Name: N-[1-[(3-acetamidophenyl)carbamoyl]-3-methylsulfanyl-propyl]-2-bromo-benzamide CAS Name: N-[1-(3-acetamidoanilino)-4-(methylthio)-1-oxobutan-2-yl]-2-bromobenzamide IUPAC Name: N-[1-(3-acetamidoanilino)-4-methylsulfanyl-1-oxobutan-2-yl]-2-bromobenzamide Traditional Name: N-[1-[(3-acetamidophenyl)carbamoyl]-3-(methylthio)propyl]-2-bromo-benzamide Formula: C20H22BrN3O3S MolecularWeight: 464.37598

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NC(=O)C(CCSC)NC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NC(=O)C(CCSC)NC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C20H22BrN3O3S/c1-13(25)22-14-6-5-7-15(12-14)23-20(27)18(10-11-28-2)24-19(26)16-8-3-4-9-17(16)21/h3-9,12,18H,10-11H2,1-2H3,(H,22,25)(H,23,27)(H,24,26)