1-[5-[2-[(4-chlorophenyl)methylsulfanyl]phenyl]-1,3,4-thiadiazol-2-yl]-3-(4-fluorophenyl)urea

Systemtic Name: 1-[5-[2-[(4-chlorophenyl)methylsulfanyl]phenyl]-1,3,4-thiadiazol-2-yl]-3-(4-fluorophenyl)urea Openeye Name: 1-[5-[2-[(4-chlorophenyl)methylsulfanyl]phenyl]-1,3,4-thiadiazol-2-yl]-3-(4-fluorophenyl)urea CAS Name: 1-[5-[2-[(4-chlorophenyl)methylthio]phenyl]-1,3,4-thiadiazol-2-yl]-3-(4-fluorophenyl)urea IUPAC Name: 1-[5-[2-[(4-chlorophenyl)methylsulfanyl]phenyl]-1,3,4-thiadiazol-2-yl]-3-(4-fluorophenyl)urea Traditional Name: 1-[5-[2-[(4-chlorobenzyl)thio]phenyl]-1,3,4-thiadiazol-2-yl]-3-(4-fluorophenyl)urea Formula: C22H16ClFN4OS2 MolecularWeight: 470.970043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NN=C(S2)NC(=O)NC3=CC=C(C=C3)F)SCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C2=NN=C(S2)NC(=O)NC3=CC=C(C=C3)F)SCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H16ClFN4OS2/c23-15-7-5-14(6-8-15)13-30-19-4-2-1-3-18(19)20-27-28-22(31-20)26-21(29)25-17-11-9-16(24)10-12-17/h1-12H,13H2,(H2,25,26,28,29)