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

Systemtic Name: methyl N-cyano-N'-(2-diethylaminoethyl)carbamimidothioate Openeye Name: 1-cyano-3-(2-diethylaminoethyl)-2-methyl-isothiourea CAS Name: N-cyano-N'-(2-diethylaminoethyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N-cyano-N'-(2-diethylaminoethyl)carbamimidothioate Traditional Name: 1-cyano-3-(2-diethylaminoethyl)-2-methyl-isothiourea Formula: C9H18N4S MolecularWeight: 214.33102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H18N4S/c1-4-13(5-2)7-6-11-9(14-3)12-8-10/h4-7H2,1-3H3,(H,11,12)