methyl N'-[[2-[(6-chloranylpyridin-3-yl)methylamino]cyclopentyl]methyl]-N-cyano-carbamimidothioate

Systemtic Name: methyl N'-[[2-[(6-chloranylpyridin-3-yl)methylamino]cyclopentyl]methyl]-N-cyano-carbamimidothioate Openeye Name: 3-[[2-[(6-chloro-3-pyridyl)methylamino]cyclopentyl]methyl]-1-cyano-2-methyl-isothiourea CAS Name: N'-[[2-[(6-chloro-3-pyridinyl)methylamino]cyclopentyl]methyl]-N-cyanocarbamimidothioic acid methyl ester IUPAC Name: methyl N'-[[2-[(6-chloropyridin-3-yl)methylamino]cyclopentyl]methyl]-N-cyanocarbamimidothioate Traditional Name: 3-[[2-[(6-chloro-3-pyridyl)methylamino]cyclopentyl]methyl]-1-cyano-2-methyl-isothiourea Formula: C15H20ClN5S MolecularWeight: 337.8708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC(=NCC1CCCC1NCC2=CN=C(C=C2)Cl)NC#N

Isomeric SMILES

CSC(=NCC1CCCC1NCC2=CN=C(C=C2)Cl)NC#N

InChI

InChI=1S/C15H20ClN5S/c1-22-15(21-10-17)20-9-12-3-2-4-13(12)18-7-11-5-6-14(16)19-8-11/h5-6,8,12-13,18H,2-4,7,9H2,1H3,(H,20,21)