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

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]urea Openeye Name: 1-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea CAS Name: 1-(3,4-dimethylphenyl)-3-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]urea IUPAC Name: 1-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea Traditional Name: 1-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-3-(3,4-dimethylphenyl)urea Formula: C18H18N4OS2 MolecularWeight: 370.49172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC2=NN=C(S2)SCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC2=NN=C(S2)SCC3=CC=CC=C3)C

InChI

InChI=1S/C18H18N4OS2/c1-12-8-9-15(10-13(12)2)19-16(23)20-17-21-22-18(25-17)24-11-14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H2,19,20,21,23)