N-[(4-phenyl-1,2,4-triazol-3-yl)methyl]-2-propan-2-ylsulfanyl-ethanamide

Systemtic Name: N-[(4-phenyl-1,2,4-triazol-3-yl)methyl]-2-propan-2-ylsulfanyl-ethanamide Openeye Name: 2-isopropylsulfanyl-N-[(4-phenyl-1,2,4-triazol-3-yl)methyl]acetamide CAS Name: N-[(4-phenyl-1,2,4-triazol-3-yl)methyl]-2-(propan-2-ylthio)acetamide IUPAC Name: N-[(4-phenyl-1,2,4-triazol-3-yl)methyl]-2-propan-2-ylsulfanylacetamide Traditional Name: 2-(isopropylthio)-N-[(4-phenyl-1,2,4-triazol-3-yl)methyl]acetamide Formula: C14H18N4OS MolecularWeight: 290.38392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCC(=O)NCC1=NN=CN1C2=CC=CC=C2

Isomeric SMILES

CC(C)SCC(=O)NCC1=NN=CN1C2=CC=CC=C2

InChI

InChI=1S/C14H18N4OS/c1-11(2)20-9-14(19)15-8-13-17-16-10-18(13)12-6-4-3-5-7-12/h3-7,10-11H,8-9H2,1-2H3,(H,15,19)