propan-2-yl 2-[[5-(4-chlorophenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: propan-2-yl 2-[[5-(4-chlorophenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: isopropyl 2-[[5-(4-chlorophenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[5-(4-chlorophenyl)-4-propyl-1,2,4-triazol-3-yl]thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[5-(4-chlorophenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[5-(4-chlorophenyl)-4-propyl-1,2,4-triazol-3-yl]thio]acetic acid isopropyl ester Formula: C16H20ClN3O2S MolecularWeight: 353.8669

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCC(=O)OC(C)C)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCN1C(=NN=C1SCC(=O)OC(C)C)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H20ClN3O2S/c1-4-9-20-15(12-5-7-13(17)8-6-12)18-19-16(20)23-10-14(21)22-11(2)3/h5-8,11H,4,9-10H2,1-3H3