3-chloranyl-N'-sulfamoyl-propanimidamide; 4-methylbenzenesulfonic acid

Systemtic Name: 3-chloranyl-N'-sulfamoyl-propanimidamide; 4-methylbenzenesulfonic acid Openeye Name: 3-chloro-N'-sulfamoyl-propanamidine; 4-methylbenzenesulfonic acid CAS Name: 3-chloro-N'-sulfamoylpropanimidamide; 4-methylbenzenesulfonic acid IUPAC Name: 3-chloro-N'-sulfamoylpropanimidamide; 4-methylbenzenesulfonic acid Traditional Name: 3-chloro-N'-sulfamoyl-propionamidine; tosylic acid Formula: C10H16ClN3O5S2 MolecularWeight: 357.83414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C(CCl)C(=NS(=O)(=O)N)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C(CCl)/C(=N\S(=O)(=O)N)/N

InChI

InChI=1S/C7H8O3S.C3H8ClN3O2S/c1-6-2-4-7(5-3-6)11(8,9)10;4-2-1-3(5)7-10(6,8)9/h2-5H,1H3,(H,8,9,10);1-2H2,(H2,5,7)(H2,6,8,9)