methyl N-cyano-N'-(3,3-dimethylbutan-2-yl)carbamimidothioate

Systemtic Name: methyl N-cyano-N'-(3,3-dimethylbutan-2-yl)carbamimidothioate Openeye Name: 1-cyano-2-methyl-3-(1,2,2-trimethylpropyl)isothiourea CAS Name: N-cyano-N'-(3,3-dimethylbutan-2-yl)carbamimidothioic acid methyl ester IUPAC Name: methyl N-cyano-N'-(3,3-dimethylbutan-2-yl)carbamimidothioate Traditional Name: 1-cyano-2-methyl-3-(1,2,2-trimethylpropyl)isothiourea Formula: C9H17N3S MolecularWeight: 199.31638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(C)C)N=C(NC#N)SC

Isomeric SMILES

CC(C(C)(C)C)N=C(NC#N)SC

InChI

InChI=1S/C9H17N3S/c1-7(9(2,3)4)12-8(13-5)11-6-10/h7H,1-5H3,(H,11,12)