[4-(1,3,4-oxadiazol-2-yl)phenyl] 2-(2,5-dimethylphenyl)sulfanylpyridine-3-carboxylate

Systemtic Name: [4-(1,3,4-oxadiazol-2-yl)phenyl] 2-(2,5-dimethylphenyl)sulfanylpyridine-3-carboxylate Openeye Name: [4-(1,3,4-oxadiazol-2-yl)phenyl] 2-(2,5-dimethylphenyl)sulfanylpyridine-3-carboxylate CAS Name: 2-[(2,5-dimethylphenyl)thio]-3-pyridinecarboxylic acid [4-(1,3,4-oxadiazol-2-yl)phenyl] ester IUPAC Name: [4-(1,3,4-oxadiazol-2-yl)phenyl] 2-(2,5-dimethylphenyl)sulfanylpyridine-3-carboxylate Traditional Name: 2-[(2,5-dimethylphenyl)thio]nicotinic acid [4-(1,3,4-oxadiazol-2-yl)phenyl] ester Formula: C22H17N3O3S MolecularWeight: 403.45368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC2=C(C=CC=N2)C(=O)OC3=CC=C(C=C3)C4=NN=CO4

Isomeric SMILES

CC1=CC(=C(C=C1)C)SC2=C(C=CC=N2)C(=O)OC3=CC=C(C=C3)C4=NN=CO4

InChI

InChI=1S/C22H17N3O3S/c1-14-5-6-15(2)19(12-14)29-21-18(4-3-11-23-21)22(26)28-17-9-7-16(8-10-17)20-25-24-13-27-20/h3-13H,1-2H3