N-cyclohexyl-N-ethyl-2-[[5-[(4-fluorophenyl)methylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide

Systemtic Name: N-cyclohexyl-N-ethyl-2-[[5-[(4-fluorophenyl)methylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide Openeye Name: N-cyclohexyl-N-ethyl-2-[[5-[(4-fluorophenyl)methylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide CAS Name: N-cyclohexyl-N-ethyl-2-[[5-[(4-fluorophenyl)methylamino]-1,3,4-thiadiazol-2-yl]thio]propanamide IUPAC Name: N-cyclohexyl-N-ethyl-2-[[5-[(4-fluorophenyl)methylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide Traditional Name: N-cyclohexyl-N-ethyl-2-[[5-[(4-fluorobenzyl)amino]-1,3,4-thiadiazol-2-yl]thio]propionamide Formula: C20H27FN4OS2 MolecularWeight: 422.582983

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCCCC1)C(=O)C(C)SC2=NN=C(S2)NCC3=CC=C(C=C3)F

Isomeric SMILES

CCN(C1CCCCC1)C(=O)C(C)SC2=NN=C(S2)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C20H27FN4OS2/c1-3-25(17-7-5-4-6-8-17)18(26)14(2)27-20-24-23-19(28-20)22-13-15-9-11-16(21)12-10-15/h9-12,14,17H,3-8,13H2,1-2H3,(H,22,23)