2-[(5-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-pyrimidin-2-yl-ethanamide

Systemtic Name: 2-[(5-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-pyrimidin-2-yl-ethanamide Openeye Name: 2-[(5-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-pyrimidin-2-yl-acetamide CAS Name: 2-[(5-butyl-1H-1,2,4-triazol-3-yl)thio]-N-(2-pyrimidinyl)acetamide IUPAC Name: 2-[(5-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-pyrimidin-2-ylacetamide Traditional Name: 2-[(5-butyl-1H-1,2,4-triazol-3-yl)thio]-N-(2-pyrimidyl)acetamide Formula: C12H16N6OS MolecularWeight: 292.36004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=NN1)SCC(=O)NC2=NC=CC=N2

Isomeric SMILES

CCCCC1=NC(=NN1)SCC(=O)NC2=NC=CC=N2

InChI

InChI=1S/C12H16N6OS/c1-2-3-5-9-15-12(18-17-9)20-8-10(19)16-11-13-6-4-7-14-11/h4,6-7H,2-3,5,8H2,1H3,(H,15,17,18)(H,13,14,16,19)