4-[[4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenyl-butan-1-one

Systemtic Name: 4-[[4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenyl-butan-1-one Openeye Name: 4-[[4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenyl-butan-1-one CAS Name: 4-[[4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-1-phenyl-1-butanone IUPAC Name: 4-[[4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenylbutan-1-one Traditional Name: 4-[[4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-1-phenyl-butan-1-one Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C=NN=C2SCCCC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1N2C=NN=C2SCCCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H19N3O2S/c1-24-18-12-6-5-10-16(18)22-14-20-21-19(22)25-13-7-11-17(23)15-8-3-2-4-9-15/h2-6,8-10,12,14H,7,11,13H2,1H3