pentyl N'-(propan-2-ylideneamino)carbamimidothioate hydroiodide

Systemtic Name: pentyl N'-(propan-2-ylideneamino)carbamimidothioate hydroiodide Openeye Name: 3-(isopropylideneamino)-2-pentyl-isothiourea hydroiodide CAS Name: N'-(propan-2-ylideneamino)carbamimidothioic acid pentyl ester hydroiodide IUPAC Name: pentyl N'-(propan-2-ylideneamino)carbamimidothioate hydroiodide Traditional Name: 2-amyl-3-(isopropylideneamino)isothiourea hydroiodide Formula: C9H20IN3S MolecularWeight: 329.24467

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC(=NN=C(C)C)N.I

Isomeric SMILES

CCCCCS/C(=N/N=C(C)C)/N.I

InChI

InChI=1S/C9H19N3S.HI/c1-4-5-6-7-13-9(10)12-11-8(2)3;/h4-7H2,1-3H3,(H2,10,12);1H