1-[5-[(4-methylphenyl)sulfanylmethyl]-1,3,4-thiadiazol-2-yl]-3-phenyl-urea

Systemtic Name: 1-[5-[(4-methylphenyl)sulfanylmethyl]-1,3,4-thiadiazol-2-yl]-3-phenyl-urea Openeye Name: 1-phenyl-3-[5-(p-tolylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]urea CAS Name: 1-[5-[[(4-methylphenyl)thio]methyl]-1,3,4-thiadiazol-2-yl]-3-phenylurea IUPAC Name: 1-[5-[(4-methylphenyl)sulfanylmethyl]-1,3,4-thiadiazol-2-yl]-3-phenylurea Traditional Name: 1-phenyl-3-[5-[(p-tolylthio)methyl]-1,3,4-thiadiazol-2-yl]urea Formula: C17H16N4OS2 MolecularWeight: 356.46514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=NN=C(S2)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=NN=C(S2)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C17H16N4OS2/c1-12-7-9-14(10-8-12)23-11-15-20-21-17(24-15)19-16(22)18-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H2,18,19,21,22)