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

Systemtic Name: 1-(3-methoxyphenyl)-3-[3-(phenylmethylsulfanyl)-1,2,4-thiadiazol-5-yl]urea Openeye Name: 1-(3-benzylsulfanyl-1,2,4-thiadiazol-5-yl)-3-(3-methoxyphenyl)urea CAS Name: 1-(3-methoxyphenyl)-3-[3-(phenylmethylthio)-1,2,4-thiadiazol-5-yl]urea IUPAC Name: 1-(3-benzylsulfanyl-1,2,4-thiadiazol-5-yl)-3-(3-methoxyphenyl)urea Traditional Name: 1-[3-(benzylthio)-1,2,4-thiadiazol-5-yl]-3-(3-methoxyphenyl)urea Formula: C17H16N4O2S2 MolecularWeight: 372.46454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)NC2=NC(=NS2)SCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)NC2=NC(=NS2)SCC3=CC=CC=C3

InChI

InChI=1S/C17H16N4O2S2/c1-23-14-9-5-8-13(10-14)18-15(22)19-16-20-17(21-25-16)24-11-12-6-3-2-4-7-12/h2-10H,11H2,1H3,(H2,18,19,20,21,22)