2-[(5-methyl-4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenethyl-ethanamide

Systemtic Name: 2-[(5-methyl-4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[(4-isopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[(5-methyl-4-propan-2-yl-1,2,4-triazol-3-yl)thio]-N-phenethylacetamide IUPAC Name: 2-[(5-methyl-4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenethylacetamide Traditional Name: 2-[(4-isopropyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-phenethyl-acetamide Formula: C16H22N4OS MolecularWeight: 318.43708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C(C)C)SCC(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CC1=NN=C(N1C(C)C)SCC(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C16H22N4OS/c1-12(2)20-13(3)18-19-16(20)22-11-15(21)17-10-9-14-7-5-4-6-8-14/h4-8,12H,9-11H2,1-3H3,(H,17,21)