3-(2,5-dimethylphenyl)sulfanyl-N'-oxidanyl-pentanimidamide

Systemtic Name: 3-(2,5-dimethylphenyl)sulfanyl-N'-oxidanyl-pentanimidamide Openeye Name: 3-(2,5-dimethylphenyl)sulfanyl-N'-hydroxy-pentanamidine CAS Name: 3-[(2,5-dimethylphenyl)thio]-N'-hydroxypentanimidamide IUPAC Name: 3-(2,5-dimethylphenyl)sulfanyl-N'-hydroxypentanimidamide Traditional Name: 3-[(2,5-dimethylphenyl)thio]-N'-hydroxy-valeramidine Formula: C13H20N2OS MolecularWeight: 252.3757

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=NO)N)SC1=C(C=CC(=C1)C)C

Isomeric SMILES

CCC(C/C(=N/O)/N)SC1=C(C=CC(=C1)C)C

InChI

InChI=1S/C13H20N2OS/c1-4-11(8-13(14)15-16)17-12-7-9(2)5-6-10(12)3/h5-7,11,16H,4,8H2,1-3H3,(H2,14,15)