1-(4-chlorophenyl)-3-[5-(phenylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]urea

Systemtic Name: 1-(4-chlorophenyl)-3-[5-(phenylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]urea Openeye Name: 1-(4-chlorophenyl)-3-[5-(phenylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]urea CAS Name: 1-(4-chlorophenyl)-3-[5-[(phenylthio)methyl]-1,3,4-thiadiazol-2-yl]urea IUPAC Name: 1-(4-chlorophenyl)-3-[5-(phenylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]urea Traditional Name: 1-(4-chlorophenyl)-3-[5-[(phenylthio)methyl]-1,3,4-thiadiazol-2-yl]urea Formula: C16H13ClN4OS2 MolecularWeight: 376.88362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC2=NN=C(S2)NC(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)SCC2=NN=C(S2)NC(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN4OS2/c17-11-6-8-12(9-7-11)18-15(22)19-16-21-20-14(24-16)10-23-13-4-2-1-3-5-13/h1-9H,10H2,(H2,18,19,21,22)