3-(3-methoxyphenyl)-N-(2-sulfanylethyl)-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(3-methoxyphenyl)-N-(2-sulfanylethyl)-1H-pyrazole-5-carboxamide Openeye Name: 3-(3-methoxyphenyl)-N-(2-sulfanylethyl)-1H-pyrazole-5-carboxamide CAS Name: N-(2-mercaptoethyl)-3-(3-methoxyphenyl)-1H-pyrazole-5-carboxamide IUPAC Name: 3-(3-methoxyphenyl)-N-(2-sulfanylethyl)-1H-pyrazole-5-carboxamide Traditional Name: N-(2-mercaptoethyl)-3-(3-methoxyphenyl)-1H-pyrazole-5-carboxamide Formula: C13H15N3O2S MolecularWeight: 277.3421

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NNC(=C2)C(=O)NCCS

Isomeric SMILES

COC1=CC=CC(=C1)C2=NNC(=C2)C(=O)NCCS

InChI

InChI=1S/C13H15N3O2S/c1-18-10-4-2-3-9(7-10)11-8-12(16-15-11)13(17)14-5-6-19/h2-4,7-8,19H,5-6H2,1H3,(H,14,17)(H,15,16)