1-(3-chloranyl-4-fluoranyl-phenyl)-3-[2-(phenylmethylsulfanyl)ethyl]thiourea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-[2-(phenylmethylsulfanyl)ethyl]thiourea Openeye Name: 1-(2-benzylsulfanylethyl)-3-(3-chloro-4-fluoro-phenyl)thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[2-(phenylmethylthio)ethyl]thiourea IUPAC Name: 1-(2-benzylsulfanylethyl)-3-(3-chloro-4-fluorophenyl)thiourea Traditional Name: 1-[2-(benzylthio)ethyl]-3-(3-chloro-4-fluoro-phenyl)thiourea Formula: C16H16ClFN2S2 MolecularWeight: 354.893043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCNC(=S)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)CSCCNC(=S)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C16H16ClFN2S2/c17-14-10-13(6-7-15(14)18)20-16(21)19-8-9-22-11-12-4-2-1-3-5-12/h1-7,10H,8-9,11H2,(H2,19,20,21)