methyl N-[(6-chloranylpyridin-3-yl)methyl]-N'-methyl-N-propan-2-yl-carbamimidothioate

Systemtic Name: methyl N-[(6-chloranylpyridin-3-yl)methyl]-N'-methyl-N-propan-2-yl-carbamimidothioate Openeye Name: 1-[(6-chloro-3-pyridyl)methyl]-1-isopropyl-2,3-dimethyl-isothiourea CAS Name: N-[(6-chloro-3-pyridinyl)methyl]-N'-methyl-N-propan-2-ylcarbamimidothioic acid methyl ester IUPAC Name: methyl N-[(6-chloropyridin-3-yl)methyl]-N'-methyl-N-propan-2-ylcarbamimidothioate Traditional Name: 1-[(6-chloro-3-pyridyl)methyl]-1-isopropyl-2,3-dimethyl-isothiourea Formula: C12H18ClN3S MolecularWeight: 271.80942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CN=C(C=C1)Cl)C(=NC)SC

Isomeric SMILES

CC(C)N(CC1=CN=C(C=C1)Cl)C(=NC)SC

InChI

InChI=1S/C12H18ClN3S/c1-9(2)16(12(14-3)17-4)8-10-5-6-11(13)15-7-10/h5-7,9H,8H2,1-4H3