N-cyclohexyl-4-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-1,4-diazepane-1-carboxamide

Systemtic Name: N-cyclohexyl-4-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-1,4-diazepane-1-carboxamide Openeye Name: N-cyclohexyl-4-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-1,4-diazepane-1-carboxamide CAS Name: N-cyclohexyl-4-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-1,4-diazepane-1-carboxamide IUPAC Name: N-cyclohexyl-4-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-1,4-diazepane-1-carboxamide Traditional Name: N-cyclohexyl-4-[3-(4-fluorobenzyl)-1,2,4-thiadiazol-5-yl]-1,4-diazepane-1-carboxamide Formula: C21H28FN5OS MolecularWeight: 417.543323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)N2CCCN(CC2)C3=NC(=NS3)CC4=CC=C(C=C4)F

Isomeric SMILES

C1CCC(CC1)NC(=O)N2CCCN(CC2)C3=NC(=NS3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C21H28FN5OS/c22-17-9-7-16(8-10-17)15-19-24-21(29-25-19)27-12-4-11-26(13-14-27)20(28)23-18-5-2-1-3-6-18/h7-10,18H,1-6,11-15H2,(H,23,28)