4-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-3-fluoranyl-N'-oxidanyl-benzenecarboximidamide

Systemtic Name: 4-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-3-fluoranyl-N'-oxidanyl-benzenecarboximidamide Openeye Name: 4-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]-3-fluoro-N'-hydroxy-benzamidine CAS Name: 4-[[(1-cyclopropyl-5-tetrazolyl)thio]methyl]-3-fluoro-N'-hydroxybenzenecarboximidamide IUPAC Name: 4-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]-3-fluoro-N'-hydroxybenzenecarboximidamide Traditional Name: 4-[[(1-cyclopropyltetrazol-5-yl)thio]methyl]-3-fluoro-N'-hydroxy-benzamidine Formula: C12H13FN6OS MolecularWeight: 308.334623

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=N2)SCC3=C(C=C(C=C3)C(=NO)N)F

Isomeric SMILES

C1CC1N2C(=NN=N2)SCC3=C(C=C(C=C3)/C(=N/O)/N)F

InChI

InChI=1S/C12H13FN6OS/c13-10-5-7(11(14)16-20)1-2-8(10)6-21-12-15-17-18-19(12)9-3-4-9/h1-2,5,9,20H,3-4,6H2,(H2,14,16)