1-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-[(4-fluorophenyl)methyl]thiourea

Systemtic Name: 1-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-[(4-fluorophenyl)methyl]thiourea Openeye Name: 1-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-[(4-fluorophenyl)methyl]thiourea CAS Name: 1-[2-[(2-cyanophenyl)methylthio]ethyl]-3-[(4-fluorophenyl)methyl]thiourea IUPAC Name: 1-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-[(4-fluorophenyl)methyl]thiourea Traditional Name: 1-[2-[(2-cyanobenzyl)thio]ethyl]-3-(4-fluorobenzyl)thiourea Formula: C18H18FN3S2 MolecularWeight: 359.484023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNC(=S)NCC2=CC=C(C=C2)F)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNC(=S)NCC2=CC=C(C=C2)F)C#N

InChI

InChI=1S/C18H18FN3S2/c19-17-7-5-14(6-8-17)12-22-18(23)21-9-10-24-13-16-4-2-1-3-15(16)11-20/h1-8H,9-10,12-13H2,(H2,21,22,23)