1-[(4-methylphenyl)methyl]-3-(3-methylsulfanylpropyl)thiourea

Systemtic Name: 1-[(4-methylphenyl)methyl]-3-(3-methylsulfanylpropyl)thiourea Openeye Name: 1-(3-methylsulfanylpropyl)-3-(p-tolylmethyl)thiourea CAS Name: 1-[(4-methylphenyl)methyl]-3-[3-(methylthio)propyl]thiourea IUPAC Name: 1-[(4-methylphenyl)methyl]-3-(3-methylsulfanylpropyl)thiourea Traditional Name: 1-(4-methylbenzyl)-3-[3-(methylthio)propyl]thiourea Formula: C13H20N2S2 MolecularWeight: 268.4413

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=S)NCCCSC

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=S)NCCCSC

InChI

InChI=1S/C13H20N2S2/c1-11-4-6-12(7-5-11)10-15-13(16)14-8-3-9-17-2/h4-7H,3,8-10H2,1-2H3,(H2,14,15,16)