2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-phenyl-2-(1,2,4-triazol-1-yl)ethanone

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-phenyl-2-(1,2,4-triazol-1-yl)ethanone Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-phenyl-2-(1,2,4-triazol-1-yl)ethanone CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-phenyl-2-(1,2,4-triazol-1-yl)ethanone IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-phenyl-2-(1,2,4-triazol-1-yl)ethanone Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-1-phenyl-2-(1,2,4-triazol-1-yl)ethanone Formula: C16H15N5OS MolecularWeight: 325.3882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC(C(=O)C2=CC=CC=C2)N3C=NC=N3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC(C(=O)C2=CC=CC=C2)N3C=NC=N3)C

InChI

InChI=1S/C16H15N5OS/c1-11-8-12(2)20-16(19-11)23-15(21-10-17-9-18-21)14(22)13-6-4-3-5-7-13/h3-10,15H,1-2H3