(3R)-3-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]oxolan-2-one

Systemtic Name: (3R)-3-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]oxolan-2-one Openeye Name: (3R)-3-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]tetrahydrofuran-2-one CAS Name: (3R)-3-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-2-oxolanone IUPAC Name: (3R)-3-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]oxolan-2-one Traditional Name: (3R)-3-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]tetrahydrofuran-2-one Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SC3CCOC3=O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)S[C@@H]3CCOC3=O

InChI

InChI=1S/C17H21N3O2S/c1-17(2,3)12-7-5-11(6-8-12)14-18-19-16(20(14)4)23-13-9-10-22-15(13)21/h5-8,13H,9-10H2,1-4H3/t13-/m1/s1