propan-2-yl 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: propan-2-yl 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: isopropyl 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]thio]acetic acid isopropyl ester Formula: C13H14ClN3O2S MolecularWeight: 311.78716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CSC1=NN=CN1C2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C)OC(=O)CSC1=NN=CN1C2=CC(=CC=C2)Cl

InChI

InChI=1S/C13H14ClN3O2S/c1-9(2)19-12(18)7-20-13-16-15-8-17(13)11-5-3-4-10(14)6-11/h3-6,8-9H,7H2,1-2H3