3-sulfanylpropyl N-azanyl-N'-cyano-N-methyl-carbamimidothioate

Systemtic Name: 3-sulfanylpropyl N-azanyl-N'-cyano-N-methyl-carbamimidothioate Openeye Name: 1-amino-3-cyano-1-methyl-2-(3-sulfanylpropyl)isothiourea CAS Name: N-amino-N'-cyano-N-methylcarbamimidothioic acid 3-mercaptopropyl ester IUPAC Name: 3-sulfanylpropyl N-amino-N'-cyano-N-methylcarbamimidothioate Traditional Name: 1-amino-3-cyano-2-(3-mercaptopropyl)-1-methyl-isothiourea Formula: C6H12N4S2 MolecularWeight: 204.31628

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=NC#N)SCCCS)N

Isomeric SMILES

CN(C(=NC#N)SCCCS)N

InChI

InChI=1S/C6H12N4S2/c1-10(8)6(9-5-7)12-4-2-3-11/h11H,2-4,8H2,1H3