methyl N,N-dimethyl-N'-(2-pyridin-3-ylethyl)carbamimidothioate

Systemtic Name: methyl N,N-dimethyl-N'-(2-pyridin-3-ylethyl)carbamimidothioate Openeye Name: 1,1,2-trimethyl-3-[2-(3-pyridyl)ethyl]isothiourea CAS Name: N,N-dimethyl-N'-[2-(3-pyridinyl)ethyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N,N-dimethyl-N'-(2-pyridin-3-ylethyl)carbamimidothioate Traditional Name: 1,1,2-trimethyl-3-[2-(3-pyridyl)ethyl]isothiourea Formula: C11H17N3S MolecularWeight: 223.33778

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=NCCC1=CN=CC=C1)SC

Isomeric SMILES

CN(C)C(=NCCC1=CN=CC=C1)SC

InChI

InChI=1S/C11H17N3S/c1-14(2)11(15-3)13-8-6-10-5-4-7-12-9-10/h4-5,7,9H,6,8H2,1-3H3