(4-methylsulfanylphenyl)methyl N'-prop-2-enylcarbamimidothioate

Systemtic Name: (4-methylsulfanylphenyl)methyl N'-prop-2-enylcarbamimidothioate Openeye Name: 3-allyl-2-[(4-methylsulfanylphenyl)methyl]isothiourea CAS Name: N'-prop-2-enylcarbamimidothioic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl N'-prop-2-enylcarbamimidothioate Traditional Name: 3-allyl-2-[4-(methylthio)benzyl]isothiourea Formula: C12H16N2S2 MolecularWeight: 252.39884

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CSC(=NCC=C)N

Isomeric SMILES

CSC1=CC=C(C=C1)CSC(=NCC=C)N

InChI

InChI=1S/C12H16N2S2/c1-3-8-14-12(13)16-9-10-4-6-11(15-2)7-5-10/h3-7H,1,8-9H2,2H3,(H2,13,14)