3-(dimethylamino)propyl (1E)-2-chloranyl-N-oxidanyl-benzenecarboximidothioate chloride

Systemtic Name: 3-(dimethylamino)propyl (1E)-2-chloranyl-N-oxidanyl-benzenecarboximidothioate chloride Openeye Name: 3-(dimethylamino)propyl (1E)-2-chloro-N-hydroxy-benzenecarboximidothioate chloride CAS Name: (1E)-2-chloro-N-hydroxybenzenecarboximidothioic acid 3-(dimethylamino)propyl ester chloride IUPAC Name: 3-(dimethylamino)propyl (1E)-2-chloro-N-hydroxybenzenecarboximidothioate chloride Traditional Name: (1E)-2-chloro-N-hydroxy-benzenecarboximidothioic acid 3-(dimethylamino)propyl ester chloride Formula: C12H17Cl2N2OS- MolecularWeight: 308.24718

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCSC(=NO)C1=CC=CC=C1Cl.[Cl-]

Isomeric SMILES

CN(C)CCCS/C(=N/O)/C1=CC=CC=C1Cl.[Cl-]

InChI

InChI=1S/C12H17ClN2OS.ClH/c1-15(2)8-5-9-17-12(14-16)10-6-3-4-7-11(10)13;/h3-4,6-7,16H,5,8-9H2,1-2H3;1H/p-1/b14-12+;