methyl N-tert-butyl-N'-(cyclopropylmethyl)carbamimidothioate iodide

Systemtic Name: methyl N-tert-butyl-N'-(cyclopropylmethyl)carbamimidothioate iodide Openeye Name: 1-tert-butyl-3-(cyclopropylmethyl)-2-methyl-isothiourea iodide CAS Name: N-tert-butyl-N'-(cyclopropylmethyl)carbamimidothioic acid methyl ester iodide IUPAC Name: methyl N-tert-butyl-N'-(cyclopropylmethyl)carbamimidothioate iodide Traditional Name: 1-tert-butyl-3-(cyclopropylmethyl)-2-methyl-isothiourea iodide Formula: C10H20IN2S- MolecularWeight: 327.24867

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=NCC1CC1)SC.[I-]

Isomeric SMILES

CC(C)(C)NC(=NCC1CC1)SC.[I-]

InChI

InChI=1S/C10H20N2S.HI/c1-10(2,3)12-9(13-4)11-7-8-5-6-8;/h8H,5-7H2,1-4H3,(H,11,12);1H/p-1