3-ethyl-1-[2-(3-methylsulfinylphenyl)butyl]-1,2,4-triazole

Systemtic Name: 3-ethyl-1-[2-(3-methylsulfinylphenyl)butyl]-1,2,4-triazole Openeye Name: 3-ethyl-1-[2-(3-methylsulfinylphenyl)butyl]-1,2,4-triazole CAS Name: 3-ethyl-1-[2-(3-methylsulfinylphenyl)butyl]-1,2,4-triazole IUPAC Name: 3-ethyl-1-[2-(3-methylsulfinylphenyl)butyl]-1,2,4-triazole Traditional Name: 3-ethyl-1-[2-(3-methylsulfinylphenyl)butyl]-1,2,4-triazole Formula: C15H21N3OS MolecularWeight: 291.41174

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C=N1)CC(CC)C2=CC(=CC=C2)S(=O)C

Isomeric SMILES

CCC1=NN(C=N1)CC(CC)C2=CC(=CC=C2)S(=O)C

InChI

InChI=1S/C15H21N3OS/c1-4-12(10-18-11-16-15(5-2)17-18)13-7-6-8-14(9-13)20(3)19/h6-9,11-12H,4-5,10H2,1-3H3