1-phenyl-3-[5-(pyridin-3-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]urea

Systemtic Name: 1-phenyl-3-[5-(pyridin-3-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]urea Openeye Name: 1-phenyl-3-[5-(3-pyridylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]urea CAS Name: 1-phenyl-3-[5-(3-pyridinylmethylthio)-1,3,4-thiadiazol-2-yl]urea IUPAC Name: 1-phenyl-3-[5-(pyridin-3-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]urea Traditional Name: 1-phenyl-3-[5-(3-pyridylmethylthio)-1,3,4-thiadiazol-2-yl]urea Formula: C15H13N5OS2 MolecularWeight: 343.42662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13N5OS2/c21-13(17-12-6-2-1-3-7-12)18-14-19-20-15(23-14)22-10-11-5-4-8-16-9-11/h1-9H,10H2,(H2,17,18,19,21)