(3-methylphenyl) 2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: (3-methylphenyl) 2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoate Openeye Name: m-tolyl 2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]thio]acetic acid (3-methylphenyl) ester IUPAC Name: (3-methylphenyl) 2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]thio]acetic acid m-tolyl ester Formula: C17H13N3O5S MolecularWeight: 371.36722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(=O)CSC2=NN=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)OC(=O)CSC2=NN=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O5S/c1-11-3-2-4-14(9-11)24-15(21)10-26-17-19-18-16(25-17)12-5-7-13(8-6-12)20(22)23/h2-9H,10H2,1H3