1-(3-chloranyl-2-methyl-phenyl)-3-(3-methylsulfanylpropyl)thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-(3-methylsulfanylpropyl)thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-(3-methylsulfanylpropyl)thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-[3-(methylthio)propyl]thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-(3-methylsulfanylpropyl)thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-[3-(methylthio)propyl]thiourea Formula: C12H17ClN2S2 MolecularWeight: 288.85978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NCCCSC

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NCCCSC

InChI

InChI=1S/C12H17ClN2S2/c1-9-10(13)5-3-6-11(9)15-12(16)14-7-4-8-17-2/h3,5-6H,4,7-8H2,1-2H3,(H2,14,15,16)