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

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[5-(2-oxidanylidenepropylsulfanyl)-1,3,4-thiadiazol-2-yl]urea Openeye Name: 1-(5-acetonylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea CAS Name: 1-(3,4-dimethylphenyl)-3-[5-(2-oxopropylthio)-1,3,4-thiadiazol-2-yl]urea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[5-(2-oxopropylsulfanyl)-1,3,4-thiadiazol-2-yl]urea Traditional Name: 1-[5-(acetonylthio)-1,3,4-thiadiazol-2-yl]-3-(3,4-dimethylphenyl)urea Formula: C14H16N4O2S2 MolecularWeight: 336.43244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC2=NN=C(S2)SCC(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC2=NN=C(S2)SCC(=O)C)C

InChI

InChI=1S/C14H16N4O2S2/c1-8-4-5-11(6-9(8)2)15-12(20)16-13-17-18-14(22-13)21-7-10(3)19/h4-6H,7H2,1-3H3,(H2,15,16,17,20)