N-[5-[(4-cyclohexylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-2-fluoranyl-benzamide

Systemtic Name: N-[5-[(4-cyclohexylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-2-fluoranyl-benzamide Openeye Name: N-[5-[(4-cyclohexylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-2-fluoro-benzamide CAS Name: N-[5-[(4-cyclohexylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-2-fluorobenzamide IUPAC Name: N-[5-[(4-cyclohexylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-2-fluorobenzamide Traditional Name: N-[5-[(4-cyclohexylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-2-fluoro-benzamide Formula: C22H22FN3O2S MolecularWeight: 411.492383

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)OCC3=NN=C(S3)NC(=O)C4=CC=CC=C4F

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)OCC3=NN=C(S3)NC(=O)C4=CC=CC=C4F

InChI

InChI=1S/C22H22FN3O2S/c23-19-9-5-4-8-18(19)21(27)24-22-26-25-20(29-22)14-28-17-12-10-16(11-13-17)15-6-2-1-3-7-15/h4-5,8-13,15H,1-3,6-7,14H2,(H,24,26,27)