N-[1-(2-acetamidoethylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2,4-bis(chloranyl)benzamide

Systemtic Name: N-[1-(2-acetamidoethylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2,4-bis(chloranyl)benzamide Openeye Name: N-[1-(2-acetamidoethylcarbamoyl)-3-methylsulfanyl-propyl]-2,4-dichloro-benzamide CAS Name: N-[1-(2-acetamidoethylamino)-4-(methylthio)-1-oxobutan-2-yl]-2,4-dichlorobenzamide IUPAC Name: N-[1-(2-acetamidoethylamino)-4-methylsulfanyl-1-oxobutan-2-yl]-2,4-dichlorobenzamide Traditional Name: N-[1-(2-acetamidoethylcarbamoyl)-3-(methylthio)propyl]-2,4-dichloro-benzamide Formula: C16H21Cl2N3O3S MolecularWeight: 406.32724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC(=O)C(CCSC)NC(=O)C1=C(C=C(C=C1)Cl)Cl

Isomeric SMILES

CC(=O)NCCNC(=O)C(CCSC)NC(=O)C1=C(C=C(C=C1)Cl)Cl

InChI

InChI=1S/C16H21Cl2N3O3S/c1-10(22)19-6-7-20-16(24)14(5-8-25-2)21-15(23)12-4-3-11(17)9-13(12)18/h3-4,9,14H,5-8H2,1-2H3,(H,19,22)(H,20,24)(H,21,23)