1-(3,4-dimethylphenyl)-3-[5-[(4-fluorophenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-yl]urea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[5-[(4-fluorophenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-yl]urea Openeye Name: 1-(3,4-dimethylphenyl)-3-[5-[(4-fluorophenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-yl]urea CAS Name: 1-(3,4-dimethylphenyl)-3-[5-[[(4-fluorophenyl)methylthio]methyl]-1,3,4-thiadiazol-2-yl]urea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[5-[(4-fluorophenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-yl]urea Traditional Name: 1-(3,4-dimethylphenyl)-3-[5-[[(4-fluorobenzyl)thio]methyl]-1,3,4-thiadiazol-2-yl]urea Formula: C19H19FN4OS2 MolecularWeight: 402.508763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC2=NN=C(S2)CSCC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC2=NN=C(S2)CSCC3=CC=C(C=C3)F)C

InChI

InChI=1S/C19H19FN4OS2/c1-12-3-8-16(9-13(12)2)21-18(25)22-19-24-23-17(27-19)11-26-10-14-4-6-15(20)7-5-14/h3-9H,10-11H2,1-2H3,(H2,21,22,24,25)