2-[[(5-isocyano-4-methyl-2-methylsulfonyl-phenyl)amino]carbamoyl]-N-methyl-N-oxidanyl-benzamide

Systemtic Name: 2-[[(5-isocyano-4-methyl-2-methylsulfonyl-phenyl)amino]carbamoyl]-N-methyl-N-oxidanyl-benzamide Openeye Name: N-hydroxy-2-[(5-isocyano-4-methyl-2-methylsulfonyl-anilino)carbamoyl]-N-methyl-benzamide CAS Name: N-hydroxy-2-[[(5-isocyano-4-methyl-2-methylsulfonylphenyl)hydrazo]-oxomethyl]-N-methylbenzamide IUPAC Name: N-hydroxy-2-[(5-isocyano-4-methyl-2-methylsulfonylanilino)carbamoyl]-N-methylbenzamide Traditional Name: N-hydroxy-2-[(5-isocyano-2-mesyl-4-methyl-anilino)carbamoyl]-N-methyl-benzamide Formula: C18H18N4O5S MolecularWeight: 402.42432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1[N+]#[C-])NNC(=O)C2=CC=CC=C2C(=O)N(C)O)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1[N+]#[C-])NNC(=O)C2=CC=CC=C2C(=O)N(C)O)S(=O)(=O)C

InChI

InChI=1S/C18H18N4O5S/c1-11-9-16(28(4,26)27)15(10-14(11)19-2)20-21-17(23)12-7-5-6-8-13(12)18(24)22(3)25/h5-10,20,25H,1,3-4H3,(H,21,23)