N-[5-(4-butylphenyl)-1,3,4-thiadiazol-2-yl]-4-phenyl-cyclohexane-1-carboxamide

Systemtic Name: N-[5-(4-butylphenyl)-1,3,4-thiadiazol-2-yl]-4-phenyl-cyclohexane-1-carboxamide Openeye Name: N-[5-(4-butylphenyl)-1,3,4-thiadiazol-2-yl]-4-phenyl-cyclohexanecarboxamide CAS Name: N-[5-(4-butylphenyl)-1,3,4-thiadiazol-2-yl]-4-phenyl-1-cyclohexanecarboxamide IUPAC Name: N-[5-(4-butylphenyl)-1,3,4-thiadiazol-2-yl]-4-phenylcyclohexane-1-carboxamide Traditional Name: N-[5-(4-butylphenyl)-1,3,4-thiadiazol-2-yl]-4-phenyl-cyclohexanecarboxamide Formula: C25H29N3OS MolecularWeight: 419.58226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C3CCC(CC3)C4=CC=CC=C4

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C3CCC(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H29N3OS/c1-2-3-7-18-10-12-22(13-11-18)24-27-28-25(30-24)26-23(29)21-16-14-20(15-17-21)19-8-5-4-6-9-19/h4-6,8-13,20-21H,2-3,7,14-17H2,1H3,(H,26,28,29)