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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)CSC2=NN=CN2C3=CC(=CC=C3)OC

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)CSC2=NN=CN2C3=CC(=CC=C3)OC

InChI

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