2-(phenylsulfonyl)ethyl [4-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanylmethanoate

Systemtic Name: 2-(phenylsulfonyl)ethyl [4-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanylmethanoate Openeye Name: 2-(benzenesulfonyl)ethyl [4-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanylformate CAS Name: [[4-(4-chlorophenyl)-1,2,4-triazol-3-yl]thio]formic acid 2-(benzenesulfonyl)ethyl ester IUPAC Name: 2-(benzenesulfonyl)ethyl [4-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanylformate Traditional Name: [[4-(4-chlorophenyl)-1,2,4-triazol-3-yl]thio]formic acid 2-besylethyl ester Formula: C17H14ClN3O4S2 MolecularWeight: 423.89376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CCOC(=O)SC2=NN=CN2C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CCOC(=O)SC2=NN=CN2C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H14ClN3O4S2/c18-13-6-8-14(9-7-13)21-12-19-20-16(21)26-17(22)25-10-11-27(23,24)15-4-2-1-3-5-15/h1-9,12H,10-11H2