methyl N'-ethyl-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]carbamimidothioate

Systemtic Name: methyl N'-ethyl-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]carbamimidothioate Openeye Name: 3-ethyl-1-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-2-methyl-isothiourea CAS Name: N'-ethyl-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-ethyl-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]carbamimidothioate Traditional Name: 3-ethyl-1-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-2-methyl-isothiourea Formula: C14H18N4OS MolecularWeight: 290.38392

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C(NC1=NNC(=C1)C2=CC=CC=C2OC)SC

Isomeric SMILES

CCN=C(NC1=NNC(=C1)C2=CC=CC=C2OC)SC

InChI

InChI=1S/C14H18N4OS/c1-4-15-14(20-3)16-13-9-11(17-18-13)10-7-5-6-8-12(10)19-2/h5-9H,4H2,1-3H3,(H2,15,16,17,18)