S-[5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl] 4-methylbenzenecarbothioate

Systemtic Name: S-[5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl] 4-methylbenzenecarbothioate Openeye Name: S-[5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl] 4-methylbenzenecarbothioate CAS Name: 4-methylbenzenecarbothioic acid S-[5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl] ester IUPAC Name: S-[5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl] 4-methylbenzenecarbothioate Traditional Name: 4-methylthiobenzoic acid S-[5-(4-chlorobenzyl)-1,3,4-oxadiazol-2-yl] ester Formula: C17H13ClN2O2S MolecularWeight: 344.81532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)SC2=NN=C(O2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)SC2=NN=C(O2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H13ClN2O2S/c1-11-2-6-13(7-3-11)16(21)23-17-20-19-15(22-17)10-12-4-8-14(18)9-5-12/h2-9H,10H2,1H3