ethyl N'-[5-(4-methoxypyridin-2-yl)-2-methyl-phenyl]carbamimidothioate

Systemtic Name: ethyl N'-[5-(4-methoxypyridin-2-yl)-2-methyl-phenyl]carbamimidothioate Openeye Name: 2-ethyl-3-[5-(4-methoxy-2-pyridyl)-2-methyl-phenyl]isothiourea CAS Name: N'-[5-(4-methoxy-2-pyridinyl)-2-methylphenyl]carbamimidothioic acid ethyl ester IUPAC Name: ethyl N'-[5-(4-methoxypyridin-2-yl)-2-methylphenyl]carbamimidothioate Traditional Name: 2-ethyl-3-[5-(4-methoxy-2-pyridyl)-2-methyl-phenyl]isothiourea Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=NC1=C(C=CC(=C1)C2=NC=CC(=C2)OC)C)N

Isomeric SMILES

CCSC(=NC1=C(C=CC(=C1)C2=NC=CC(=C2)OC)C)N

InChI

InChI=1S/C16H19N3OS/c1-4-21-16(17)19-14-9-12(6-5-11(14)2)15-10-13(20-3)7-8-18-15/h5-10H,4H2,1-3H3,(H2,17,19)