1-methyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]pyrazole-4-carboxamide

Systemtic Name: 1-methyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]pyrazole-4-carboxamide Openeye Name: 1-methyl-N-[2-(2-thienylmethylsulfanyl)ethyl]pyrazole-4-carboxamide CAS Name: 1-methyl-N-[2-(thiophen-2-ylmethylthio)ethyl]-4-pyrazolecarboxamide IUPAC Name: 1-methyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]pyrazole-4-carboxamide Traditional Name: 1-methyl-N-[2-(2-thenylthio)ethyl]pyrazole-4-carboxamide Formula: C12H15N3OS2 MolecularWeight: 281.397

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(=O)NCCSCC2=CC=CS2

Isomeric SMILES

CN1C=C(C=N1)C(=O)NCCSCC2=CC=CS2

InChI

InChI=1S/C12H15N3OS2/c1-15-8-10(7-14-15)12(16)13-4-6-17-9-11-3-2-5-18-11/h2-3,5,7-8H,4,6,9H2,1H3,(H,13,16)