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

Systemtic Name: 3-chloranyl-N-[5-[(4-cyclohexylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3-chloro-N-[5-[(4-cyclohexylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3-chloro-N-[5-[(4-cyclohexylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3-chloro-N-[5-[(4-cyclohexylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 3-chloro-N-[5-[(4-cyclohexylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]benzamide Formula: C22H22ClN3O2S MolecularWeight: 427.94698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22ClN3O2S/c23-18-8-4-7-17(13-18)21(27)24-22-26-25-20(29-22)14-28-19-11-9-16(10-12-19)15-5-2-1-3-6-15/h4,7-13,15H,1-3,5-6,14H2,(H,24,26,27)