2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(2,4,5-trimethylphenyl)propan-1-one

Systemtic Name: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(2,4,5-trimethylphenyl)propan-1-one Openeye Name: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(2,4,5-trimethylphenyl)propan-1-one CAS Name: 2-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-(2,4,5-trimethylphenyl)-1-propanone IUPAC Name: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(2,4,5-trimethylphenyl)propan-1-one Traditional Name: 2-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-(2,4,5-trimethylphenyl)propan-1-one Formula: C15H19N3OS MolecularWeight: 289.39586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)C(C)SC2=NN=CN2C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)C(C)SC2=NN=CN2C)C)C

InChI

InChI=1S/C15H19N3OS/c1-9-6-11(3)13(7-10(9)2)14(19)12(4)20-15-17-16-8-18(15)5/h6-8,12H,1-5H3