1-methyl-N-(2-phenylsulfanylethyl)pyrazole-4-carboxamide

Systemtic Name: 1-methyl-N-(2-phenylsulfanylethyl)pyrazole-4-carboxamide Openeye Name: 1-methyl-N-(2-phenylsulfanylethyl)pyrazole-4-carboxamide CAS Name: 1-methyl-N-[2-(phenylthio)ethyl]-4-pyrazolecarboxamide IUPAC Name: 1-methyl-N-(2-phenylsulfanylethyl)pyrazole-4-carboxamide Traditional Name: 1-methyl-N-[2-(phenylthio)ethyl]pyrazole-4-carboxamide Formula: C13H15N3OS MolecularWeight: 261.3427

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(=O)NCCSC2=CC=CC=C2

Isomeric SMILES

CN1C=C(C=N1)C(=O)NCCSC2=CC=CC=C2

InChI

InChI=1S/C13H15N3OS/c1-16-10-11(9-15-16)13(17)14-7-8-18-12-5-3-2-4-6-12/h2-6,9-10H,7-8H2,1H3,(H,14,17)