N'-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoyl]-1,5-diphenyl-1,2,4-triazole-3-carbohydrazide

Systemtic Name: N'-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoyl]-1,5-diphenyl-1,2,4-triazole-3-carbohydrazide Openeye Name: N'-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]-1,5-diphenyl-1,2,4-triazole-3-carbohydrazide CAS Name: N'-[2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-oxoethyl]-1,5-diphenyl-1,2,4-triazole-3-carbohydrazide IUPAC Name: N'-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]-1,5-diphenyl-1,2,4-triazole-3-carbohydrazide Traditional Name: N'-[2-[(4,6-dimethylpyrimidin-2-yl)thio]acetyl]-1,5-diphenyl-1,2,4-triazole-3-carbohydrazide Formula: C23H21N7O2S MolecularWeight: 459.52354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NNC(=O)C2=NN(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NNC(=O)C2=NN(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C23H21N7O2S/c1-15-13-16(2)25-23(24-15)33-14-19(31)27-28-22(32)20-26-21(17-9-5-3-6-10-17)30(29-20)18-11-7-4-8-12-18/h3-13H,14H2,1-2H3,(H,27,31)(H,28,32)