(4-methylphenyl)methyl N'-azanylcarbamimidothioate chloride

Systemtic Name: (4-methylphenyl)methyl N'-azanylcarbamimidothioate chloride Openeye Name: 3-amino-2-(p-tolylmethyl)isothiourea chloride CAS Name: N'-aminocarbamimidothioic acid (4-methylphenyl)methyl ester chloride IUPAC Name: (4-methylphenyl)methyl N'-aminocarbamimidothioate chloride Traditional Name: 3-amino-2-(4-methylbenzyl)isothiourea chloride Formula: C9H13ClN3S- MolecularWeight: 230.73762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H13N3S.ClH/c1-7-2-4-8(5-3-7)6-13-9(10)12-11;/h2-5H,6,11H2,1H3,(H2,10,12);1H/p-1