(2,4,6-trimethylphenyl)methyl N'-azanylcarbamimidothioate chloride

Systemtic Name: (2,4,6-trimethylphenyl)methyl N'-azanylcarbamimidothioate chloride Openeye Name: 3-amino-2-[(2,4,6-trimethylphenyl)methyl]isothiourea chloride CAS Name: N'-aminocarbamimidothioic acid (2,4,6-trimethylphenyl)methyl ester chloride IUPAC Name: (2,4,6-trimethylphenyl)methyl N'-aminocarbamimidothioate chloride Traditional Name: 3-amino-2-(2,4,6-trimethylbenzyl)isothiourea chloride Formula: C11H17ClN3S- MolecularWeight: 258.79078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)CSC(=NN)N)C.[Cl-]

Isomeric SMILES

CC1=CC(=C(C(=C1)C)CS/C(=N/N)/N)C.[Cl-]

InChI

InChI=1S/C11H17N3S.ClH/c1-7-4-8(2)10(9(3)5-7)6-15-11(12)14-13;/h4-5H,6,13H2,1-3H3,(H2,12,14);1H/p-1