methyl N'-but-2-ynyl-N-cyano-carbamimidothioate

Systemtic Name: methyl N'-but-2-ynyl-N-cyano-carbamimidothioate Openeye Name: 3-but-2-ynyl-1-cyano-2-methyl-isothiourea CAS Name: N'-but-2-ynyl-N-cyanocarbamimidothioic acid methyl ester IUPAC Name: methyl N'-but-2-ynyl-N-cyanocarbamimidothioate Traditional Name: 3-but-2-ynyl-1-cyano-2-methyl-isothiourea Formula: C7H9N3S MolecularWeight: 167.23146

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCN=C(NC#N)SC

Isomeric SMILES

CC#CCN=C(NC#N)SC

InChI

InChI=1S/C7H9N3S/c1-3-4-5-9-7(11-2)10-6-8/h5H2,1-2H3,(H,9,10)