1-(2-methylphenyl)-3-(3-prop-2-enylsulfanyl-1,2,4-thiadiazol-5-yl)urea

Systemtic Name: 1-(2-methylphenyl)-3-(3-prop-2-enylsulfanyl-1,2,4-thiadiazol-5-yl)urea Openeye Name: 1-(3-allylsulfanyl-1,2,4-thiadiazol-5-yl)-3-(o-tolyl)urea CAS Name: 1-(2-methylphenyl)-3-[3-(prop-2-enylthio)-1,2,4-thiadiazol-5-yl]urea IUPAC Name: 1-(2-methylphenyl)-3-(3-prop-2-enylsulfanyl-1,2,4-thiadiazol-5-yl)urea Traditional Name: 1-[3-(allylthio)-1,2,4-thiadiazol-5-yl]-3-(o-tolyl)urea Formula: C13H14N4OS2 MolecularWeight: 306.40646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NC2=NC(=NS2)SCC=C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NC2=NC(=NS2)SCC=C

InChI

InChI=1S/C13H14N4OS2/c1-3-8-19-13-16-12(20-17-13)15-11(18)14-10-7-5-4-6-9(10)2/h3-7H,1,8H2,2H3,(H2,14,15,16,17,18)