2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[3-(2-methylpyrimidin-4-yl)phenyl]ethanamide

Systemtic Name: 2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[3-(2-methylpyrimidin-4-yl)phenyl]ethanamide Openeye Name: 2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[3-(2-methylpyrimidin-4-yl)phenyl]acetamide CAS Name: 2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-N-[3-(2-methyl-4-pyrimidinyl)phenyl]acetamide IUPAC Name: 2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[3-(2-methylpyrimidin-4-yl)phenyl]acetamide Traditional Name: 2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-[3-(2-methylpyrimidin-4-yl)phenyl]acetamide Formula: C21H20N6OS2 MolecularWeight: 436.5531

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=CC=CC(=C2)C3=NC(=NC=C3)C)C4=CC=CS4

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=CC=CC(=C2)C3=NC(=NC=C3)C)C4=CC=CS4

InChI

InChI=1S/C21H20N6OS2/c1-3-27-20(18-8-5-11-29-18)25-26-21(27)30-13-19(28)24-16-7-4-6-15(12-16)17-9-10-22-14(2)23-17/h4-12H,3,13H2,1-2H3,(H,24,28)