N-(2-phenylsulfanylethyl)-1H-1,2,4-triazole-5-carboxamide

Systemtic Name: N-(2-phenylsulfanylethyl)-1H-1,2,4-triazole-5-carboxamide Openeye Name: N-(2-phenylsulfanylethyl)-1H-1,2,4-triazole-5-carboxamide CAS Name: N-[2-(phenylthio)ethyl]-1H-1,2,4-triazole-5-carboxamide IUPAC Name: N-(2-phenylsulfanylethyl)-1H-1,2,4-triazole-5-carboxamide Traditional Name: N-[2-(phenylthio)ethyl]-1H-1,2,4-triazole-5-carboxamide Formula: C11H12N4OS MolecularWeight: 248.30418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCNC(=O)C2=NC=NN2

Isomeric SMILES

C1=CC=C(C=C1)SCCNC(=O)C2=NC=NN2

InChI

InChI=1S/C11H12N4OS/c16-11(10-13-8-14-15-10)12-6-7-17-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H,12,16)(H,13,14,15)