methyl N'-(2-chloroethyl)-N-cyano-carbamimidothioate

Systemtic Name: methyl N'-(2-chloroethyl)-N-cyano-carbamimidothioate Openeye Name: 3-(2-chloroethyl)-1-cyano-2-methyl-isothiourea CAS Name: N'-(2-chloroethyl)-N-cyanocarbamimidothioic acid methyl ester IUPAC Name: methyl N'-(2-chloroethyl)-N-cyanocarbamimidothioate Traditional Name: 3-(2-chloroethyl)-1-cyano-2-methyl-isothiourea Formula: C5H8ClN3S MolecularWeight: 177.65512

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NCCCl)NC#N

Isomeric SMILES

CSC(=NCCCl)NC#N

InChI

InChI=1S/C5H8ClN3S/c1-10-5(9-4-7)8-3-2-6/h2-3H2,1H3,(H,8,9)