5-[bis(azanyl)methylideneamino]-2-(3-fluorophenyl)sulfinyl-N-oxidanyl-pentanamide

Systemtic Name: 5-[bis(azanyl)methylideneamino]-2-(3-fluorophenyl)sulfinyl-N-oxidanyl-pentanamide Openeye Name: 2-(3-fluorophenyl)sulfinyl-5-guanidino-pentanehydroxamic acid CAS Name: 5-(diaminomethylideneamino)-2-(3-fluorophenyl)sulfinyl-N-hydroxypentanamide IUPAC Name: 5-(diaminomethylideneamino)-2-(3-fluorophenyl)sulfinyl-N-hydroxypentanamide Traditional Name: 2-(3-fluorophenyl)sulfinyl-5-guanidino-pentanehydroxamic acid Formula: C12H17FN4O3S MolecularWeight: 316.351783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)C(CCCN=C(N)N)C(=O)NO)F

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)C(CCCN=C(N)N)C(=O)NO)F

InChI

InChI=1S/C12H17FN4O3S/c13-8-3-1-4-9(7-8)21(20)10(11(18)17-19)5-2-6-16-12(14)15/h1,3-4,7,10,19H,2,5-6H2,(H,17,18)(H4,14,15,16)