methyl N'-[2-[(4-methoxyphenyl)methyl-pyridin-2-yl-amino]ethyl]carbamimidothioate

Systemtic Name: methyl N'-[2-[(4-methoxyphenyl)methyl-pyridin-2-yl-amino]ethyl]carbamimidothioate Openeye Name: 3-[2-[(4-methoxyphenyl)methyl-(2-pyridyl)amino]ethyl]-2-methyl-isothiourea CAS Name: N'-[2-[(4-methoxyphenyl)methyl-(2-pyridinyl)amino]ethyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-[2-[(4-methoxyphenyl)methyl-pyridin-2-ylamino]ethyl]carbamimidothioate Traditional Name: 2-methyl-3-[2-[p-anisyl(2-pyridyl)amino]ethyl]isothiourea Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(CCN=C(N)SC)C2=CC=CC=N2

Isomeric SMILES

COC1=CC=C(C=C1)CN(CCN=C(N)SC)C2=CC=CC=N2

InChI

InChI=1S/C17H22N4OS/c1-22-15-8-6-14(7-9-15)13-21(12-11-20-17(18)23-2)16-5-3-4-10-19-16/h3-10H,11-13H2,1-2H3,(H2,18,20)