4-(4-nitrophenyl)sulfanyl-N'-oxidanyl-benzenecarboximidamide

Systemtic Name: 4-(4-nitrophenyl)sulfanyl-N'-oxidanyl-benzenecarboximidamide Openeye Name: N'-hydroxy-4-(4-nitrophenyl)sulfanyl-benzamidine CAS Name: N'-hydroxy-4-[(4-nitrophenyl)thio]benzenecarboximidamide IUPAC Name: N'-hydroxy-4-(4-nitrophenyl)sulfanylbenzenecarboximidamide Traditional Name: N'-hydroxy-4-[(4-nitrophenyl)thio]benzamidine Formula: C13H11N3O3S MolecularWeight: 289.30974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=NO)N)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1/C(=N/O)/N)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H11N3O3S/c14-13(15-17)9-1-5-11(6-2-9)20-12-7-3-10(4-8-12)16(18)19/h1-8,17H,(H2,14,15)