2-[(4-ethyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-ethanone

Systemtic Name: 2-[(4-ethyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-ethanone Openeye Name: 2-[(4-ethyl-5-isopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-ethanone CAS Name: 2-[(4-ethyl-5-propan-2-yl-1,2,4-triazol-3-yl)thio]-1-phenylethanone IUPAC Name: 2-[(4-ethyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-phenylethanone Traditional Name: 2-[(4-ethyl-5-isopropyl-1,2,4-triazol-3-yl)thio]-1-phenyl-ethanone Formula: C15H19N3OS MolecularWeight: 289.39586

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)C2=CC=CC=C2)C(C)C

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)C2=CC=CC=C2)C(C)C

InChI

InChI=1S/C15H19N3OS/c1-4-18-14(11(2)3)16-17-15(18)20-10-13(19)12-8-6-5-7-9-12/h5-9,11H,4,10H2,1-3H3