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

Systemtic Name: (2S)-2-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenyl-propan-1-one Openeye Name: (2S)-2-[[4-methyl-5-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenyl-propan-1-one CAS Name: (2S)-2-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]-1-phenyl-1-propanone IUPAC Name: (2S)-2-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenylpropan-1-one Traditional Name: (2S)-2-[[4-methyl-5-(o-tolyl)-1,2,4-triazol-3-yl]thio]-1-phenyl-propan-1-one Formula: C19H19N3OS MolecularWeight: 337.43866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(N2C)SC(C)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(N2C)S[C@@H](C)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H19N3OS/c1-13-9-7-8-12-16(13)18-20-21-19(22(18)3)24-14(2)17(23)15-10-5-4-6-11-15/h4-12,14H,1-3H3/t14-/m0/s1