1-(3,5-dimethylphenyl)-3-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]thiourea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]thiourea Openeye Name: 1-(3,5-dimethylphenyl)-3-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]thiourea CAS Name: 1-(3,5-dimethylphenyl)-3-[2-[(2-fluorophenyl)methylthio]ethyl]thiourea IUPAC Name: 1-(3,5-dimethylphenyl)-3-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]thiourea Traditional Name: 1-(3,5-dimethylphenyl)-3-[2-[(2-fluorobenzyl)thio]ethyl]thiourea Formula: C18H21FN2S2 MolecularWeight: 348.501143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)NCCSCC2=CC=CC=C2F)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)NCCSCC2=CC=CC=C2F)C

InChI

InChI=1S/C18H21FN2S2/c1-13-9-14(2)11-16(10-13)21-18(22)20-7-8-23-12-15-5-3-4-6-17(15)19/h3-6,9-11H,7-8,12H2,1-2H3,(H2,20,21,22)