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

Systemtic Name: 3-[(1-methylpyrrol-2-yl)methyl]-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-benzyl-3-[(1-methylpyrrol-2-yl)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-[(1-methyl-2-pyrrolyl)methyl]-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-benzyl-3-[(1-methylpyrrol-2-yl)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-benzyl-3-[(1-methylpyrrol-2-yl)methyl]-1H-1,2,4-triazole-5-thione Formula: C15H16N4S MolecularWeight: 284.37934

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CC2=NNC(=S)N2CC3=CC=CC=C3

Isomeric SMILES

CN1C=CC=C1CC2=NNC(=S)N2CC3=CC=CC=C3

InChI

InChI=1S/C15H16N4S/c1-18-9-5-8-13(18)10-14-16-17-15(20)19(14)11-12-6-3-2-4-7-12/h2-9H,10-11H2,1H3,(H,17,20)