methyl N'-[(E)-(phenylmethylidene)amino]carbamimidothioate hydroiodide

Systemtic Name: methyl N'-[(E)-(phenylmethylidene)amino]carbamimidothioate hydroiodide Openeye Name: 3-[(E)-benzylideneamino]-2-methyl-isothiourea hydroiodide CAS Name: N'-[(E)-(phenylmethylene)amino]carbamimidothioic acid methyl ester hydroiodide IUPAC Name: methyl N'-[(E)-benzylideneamino]carbamimidothioate hydroiodide Traditional Name: 3-[(E)-benzalamino]-2-methyl-isothiourea hydroiodide Formula: C9H12IN3S MolecularWeight: 321.18115

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NN=CC1=CC=CC=C1)N.I

Isomeric SMILES

CS/C(=N\N=C\C1=CC=CC=C1)/N.I

InChI

InChI=1S/C9H11N3S.HI/c1-13-9(10)12-11-7-8-5-3-2-4-6-8;/h2-7H,1H3,(H2,10,12);1H/b11-7+;