methyl N-[[2,5-bis(chloranyl)pyridin-3-yl]methyl]-N'-cyano-N-methyl-carbamimidothioate

Systemtic Name: methyl N-[[2,5-bis(chloranyl)pyridin-3-yl]methyl]-N'-cyano-N-methyl-carbamimidothioate Openeye Name: 3-cyano-1-[(2,5-dichloro-3-pyridyl)methyl]-1,2-dimethyl-isothiourea CAS Name: N'-cyano-N-[(2,5-dichloro-3-pyridinyl)methyl]-N-methylcarbamimidothioic acid methyl ester IUPAC Name: methyl N'-cyano-N-[(2,5-dichloropyridin-3-yl)methyl]-N-methylcarbamimidothioate Traditional Name: 3-cyano-1-[(2,5-dichloro-3-pyridyl)methyl]-1,2-dimethyl-isothiourea Formula: C10H10Cl2N4S MolecularWeight: 289.1842

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CN=C1Cl)Cl)C(=NC#N)SC

Isomeric SMILES

CN(CC1=CC(=CN=C1Cl)Cl)C(=NC#N)SC

InChI

InChI=1S/C10H10Cl2N4S/c1-16(10(17-2)15-6-13)5-7-3-8(11)4-14-9(7)12/h3-4H,5H2,1-2H3