N-[bis(azanyl)methylidene]-2-fluoranyl-5-methylsulfonyl-4-propyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-fluoranyl-5-methylsulfonyl-4-propyl-benzamide Openeye Name: N-(diaminomethylene)-2-fluoro-5-methylsulfonyl-4-propyl-benzamide CAS Name: N-(diaminomethylidene)-2-fluoro-5-methylsulfonyl-4-propylbenzamide IUPAC Name: N-(diaminomethylidene)-2-fluoro-5-methylsulfonyl-4-propylbenzamide Traditional Name: N-(diaminomethylene)-2-fluoro-5-mesyl-4-propyl-benzamide Formula: C12H16FN3O3S MolecularWeight: 301.337143

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(C(=C1)F)C(=O)N=C(N)N)S(=O)(=O)C

Isomeric SMILES

CCCC1=C(C=C(C(=C1)F)C(=O)N=C(N)N)S(=O)(=O)C

InChI

InChI=1S/C12H16FN3O3S/c1-3-4-7-5-9(13)8(11(17)16-12(14)15)6-10(7)20(2,18)19/h5-6H,3-4H2,1-2H3,(H4,14,15,16,17)