N-[bis(azanyl)methylidene]-2-methyl-5-methylsulfonyl-4-propan-2-yloxy-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-methyl-5-methylsulfonyl-4-propan-2-yloxy-benzamide Openeye Name: N-(diaminomethylene)-4-isopropoxy-2-methyl-5-methylsulfonyl-benzamide CAS Name: N-(diaminomethylidene)-2-methyl-5-methylsulfonyl-4-propan-2-yloxybenzamide IUPAC Name: N-(diaminomethylidene)-2-methyl-5-methylsulfonyl-4-propan-2-yloxybenzamide Traditional Name: N-(diaminomethylene)-4-isopropoxy-5-mesyl-2-methyl-benzamide Formula: C13H19N3O4S MolecularWeight: 313.37266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)OC(C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)OC(C)C

InChI

InChI=1S/C13H19N3O4S/c1-7(2)20-10-5-8(3)9(12(17)16-13(14)15)6-11(10)21(4,18)19/h5-7H,1-4H3,(H4,14,15,16,17)