2-[(5,6-dimethyl-7-oxidanylidene-1H-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]-N-phenyl-ethanamide

Systemtic Name: 2-[(5,6-dimethyl-7-oxidanylidene-1H-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[(5,6-dimethyl-7-oxo-1H-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]-N-phenyl-acetamide CAS Name: 2-[(5,6-dimethyl-7-oxo-1H-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)thio]-N-phenylacetamide IUPAC Name: 2-[(5,6-dimethyl-7-oxo-1H-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]-N-phenylacetamide Traditional Name: 2-[(7-keto-5,6-dimethyl-1H-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)thio]-N-phenyl-acetamide Formula: C15H15N5O2S MolecularWeight: 329.3769

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(=NC1=O)NN=C2SCC(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(N2C(=NC1=O)NN=C2SCC(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C15H15N5O2S/c1-9-10(2)20-14(17-13(9)22)18-19-15(20)23-8-12(21)16-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3,(H,16,21)(H,17,18,22)