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

Systemtic Name: S-[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl] 4-methylbenzenecarbothioate Openeye Name: S-(5-benzyl-1,3,4-oxadiazol-2-yl) 4-methylbenzenecarbothioate CAS Name: 4-methylbenzenecarbothioic acid S-[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl] ester IUPAC Name: S-(5-benzyl-1,3,4-oxadiazol-2-yl) 4-methylbenzenecarbothioate Traditional Name: 4-methylthiobenzoic acid S-(5-benzyl-1,3,4-oxadiazol-2-yl) ester Formula: C17H14N2O2S MolecularWeight: 310.37026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N2O2S/c1-12-7-9-14(10-8-12)16(20)22-17-19-18-15(21-17)11-13-5-3-2-4-6-13/h2-10H,11H2,1H3