5-[(1-methylpyrrol-2-yl)methyl]-3-methylsulfanyl-1H-1,2,4-triazole

Systemtic Name: 5-[(1-methylpyrrol-2-yl)methyl]-3-methylsulfanyl-1H-1,2,4-triazole Openeye Name: 5-[(1-methylpyrrol-2-yl)methyl]-3-methylsulfanyl-1H-1,2,4-triazole CAS Name: 5-[(1-methyl-2-pyrrolyl)methyl]-3-(methylthio)-1H-1,2,4-triazole IUPAC Name: 5-[(1-methylpyrrol-2-yl)methyl]-3-methylsulfanyl-1H-1,2,4-triazole Traditional Name: 5-[(1-methylpyrrol-2-yl)methyl]-3-(methylthio)-1H-1,2,4-triazole Formula: C9H12N4S MolecularWeight: 208.28338

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CC2=NC(=NN2)SC

Isomeric SMILES

CN1C=CC=C1CC2=NC(=NN2)SC

InChI

InChI=1S/C9H12N4S/c1-13-5-3-4-7(13)6-8-10-9(14-2)12-11-8/h3-5H,6H2,1-2H3,(H,10,11,12)