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

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

Systemtic Name:4-[5-(4-cyclohexylphenyl)-1,3,4-thiadiazol-2-yl]benzoic acid
Openeye Name:4-[5-(4-cyclohexylphenyl)-1,3,4-thiadiazol-2-yl]benzoic acid
CAS Name:4-[5-(4-cyclohexylphenyl)-1,3,4-thiadiazol-2-yl]benzoic acid
IUPAC Name:4-[5-(4-cyclohexylphenyl)-1,3,4-thiadiazol-2-yl]benzoic acid
Traditional Name:4-[5-(4-cyclohexylphenyl)-1,3,4-thiadiazol-2-yl]benzoic acid
Formula: C21H20N2O2S
MolecularWeight: 364.4607
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)C3=NN=C(S3)C4=CC=C(C=C4)C(=O)O


Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)C3=NN=C(S3)C4=CC=C(C=C4)C(=O)O


InChI

InChI=1S/C21H20N2O2S/c24-21(25)18-12-10-17(11-13-18)20-23-22-19(26-20)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h6-14H,1-5H2,(H,24,25)


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