N-[bis(azanyl)methylidene]-4-(2-methylpropoxy)-3-methylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-(2-methylpropoxy)-3-methylsulfonyl-benzamide Openeye Name: N-(diaminomethylene)-4-isobutoxy-3-methylsulfonyl-benzamide CAS Name: N-(diaminomethylidene)-4-(2-methylpropoxy)-3-methylsulfonylbenzamide IUPAC Name: N-(diaminomethylidene)-4-(2-methylpropoxy)-3-methylsulfonylbenzamide Traditional Name: N-(diaminomethylene)-4-isobutoxy-3-mesyl-benzamide Formula: C13H19N3O4S MolecularWeight: 313.37266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(=O)N=C(N)N)S(=O)(=O)C

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(=O)N=C(N)N)S(=O)(=O)C

InChI

InChI=1S/C13H19N3O4S/c1-8(2)7-20-10-5-4-9(12(17)16-13(14)15)6-11(10)21(3,18)19/h4-6,8H,7H2,1-3H3,(H4,14,15,16,17)