N-[1-[4-(5-chloranyl-2-methyl-phenyl)-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]ethyl]naphthalene-1-carboxamide

Systemtic Name: N-[1-[4-(5-chloranyl-2-methyl-phenyl)-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]ethyl]naphthalene-1-carboxamide Openeye Name: N-[1-[4-(5-chloro-2-methyl-phenyl)-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]ethyl]naphthalene-1-carboxamide CAS Name: N-[1-[4-(5-chloro-2-methylphenyl)-5-[(4-fluorophenyl)methylthio]-1,2,4-triazol-3-yl]ethyl]-1-naphthalenecarboxamide IUPAC Name: N-[1-[4-(5-chloro-2-methylphenyl)-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]ethyl]naphthalene-1-carboxamide Traditional Name: N-[1-[4-(5-chloro-2-methyl-phenyl)-5-[(4-fluorobenzyl)thio]-1,2,4-triazol-3-yl]ethyl]-1-naphthamide Formula: C29H24ClFN4OS MolecularWeight: 531.043463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2C(=NN=C2SCC3=CC=C(C=C3)F)C(C)NC(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2C(=NN=C2SCC3=CC=C(C=C3)F)C(C)NC(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C29H24ClFN4OS/c1-18-10-13-22(30)16-26(18)35-27(33-34-29(35)37-17-20-11-14-23(31)15-12-20)19(2)32-28(36)25-9-5-7-21-6-3-4-8-24(21)25/h3-16,19H,17H2,1-2H3,(H,32,36)