2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-propan-2-ylphenyl)ethanone

Systemtic Name: 2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-propan-2-ylphenyl)ethanone Openeye Name: 1-(4-isopropylphenyl)-2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-1-(4-propan-2-ylphenyl)ethanone IUPAC Name: 2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-propan-2-ylphenyl)ethanone Traditional Name: 2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-1-p-cumenyl-ethanone Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)CSC2=NN=CN2C3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)CSC2=NN=CN2C3=CC(=CC=C3)OC

InChI

InChI=1S/C20H21N3O2S/c1-14(2)15-7-9-16(10-8-15)19(24)12-26-20-22-21-13-23(20)17-5-4-6-18(11-17)25-3/h4-11,13-14H,12H2,1-3H3