4-(2-diethylaminoethyl)-3-(4,6-dimethylpyrimidin-2-yl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(2-diethylaminoethyl)-3-(4,6-dimethylpyrimidin-2-yl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(2-diethylaminoethyl)-3-(4,6-dimethylpyrimidin-2-yl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(2-diethylaminoethyl)-3-(4,6-dimethyl-2-pyrimidinyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(2-diethylaminoethyl)-3-(4,6-dimethylpyrimidin-2-yl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(2-diethylaminoethyl)-3-(4,6-dimethylpyrimidin-2-yl)-1H-1,2,4-triazole-5-thione Formula: C14H22N6S MolecularWeight: 306.42968

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C(=NNC1=S)C2=NC(=CC(=N2)C)C

Isomeric SMILES

CCN(CC)CCN1C(=NNC1=S)C2=NC(=CC(=N2)C)C

InChI

InChI=1S/C14H22N6S/c1-5-19(6-2)7-8-20-13(17-18-14(20)21)12-15-10(3)9-11(4)16-12/h9H,5-8H2,1-4H3,(H,18,21)