1-[1-[5-[(4-fluorophenyl)methylsulfanyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]-2-phenyl-ethyl]-3-naphthalen-1-yl-urea

Systemtic Name: 1-[1-[5-[(4-fluorophenyl)methylsulfanyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]-2-phenyl-ethyl]-3-naphthalen-1-yl-urea Openeye Name: 1-[1-[5-[(4-fluorophenyl)methylsulfanyl]-4-(p-tolyl)-1,2,4-triazol-3-yl]-2-phenyl-ethyl]-3-(1-naphthyl)urea CAS Name: 1-[1-[5-[(4-fluorophenyl)methylthio]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]-2-phenylethyl]-3-(1-naphthalenyl)urea IUPAC Name: 1-[1-[5-[(4-fluorophenyl)methylsulfanyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]-2-phenylethyl]-3-naphthalen-1-ylurea Traditional Name: 1-[1-[5-[(4-fluorobenzyl)thio]-4-(p-tolyl)-1,2,4-triazol-3-yl]-2-phenyl-ethyl]-3-(1-naphthyl)urea Formula: C35H30FN5OS MolecularWeight: 587.709003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)F)C(CC4=CC=CC=C4)NC(=O)NC5=CC=CC6=CC=CC=C65

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)F)C(CC4=CC=CC=C4)NC(=O)NC5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C35H30FN5OS/c1-24-14-20-29(21-15-24)41-33(39-40-35(41)43-23-26-16-18-28(36)19-17-26)32(22-25-8-3-2-4-9-25)38-34(42)37-31-13-7-11-27-10-5-6-12-30(27)31/h2-21,32H,22-23H2,1H3,(H2,37,38,42)