4-[2-methyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]benzoic acid

Systemtic Name: 4-[2-methyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]benzoic acid Openeye Name: 4-[2-methyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]benzoic acid CAS Name: 4-[2-methyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]benzoic acid IUPAC Name: 4-[2-methyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]benzoic acid Traditional Name: 4-[2-methyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]benzoic acid Formula: C17H14N2O2S MolecularWeight: 310.37026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NN=C(S2)C)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NN=C(S2)C)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C17H14N2O2S/c1-10-9-14(16-19-18-11(2)22-16)7-8-15(10)12-3-5-13(6-4-12)17(20)21/h3-9H,1-2H3,(H,20,21)