4-[[3-bromanyl-5-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]methylamino]-3-phenyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[[3-bromanyl-5-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]methylamino]-3-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[[3-bromo-5-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]methylamino]-3-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 4-[[3-bromo-5-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]methylamino]-3-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[[3-bromo-5-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]methylamino]-3-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[[3-bromo-5-ethoxy-4-(2-fluorobenzyl)oxy-benzyl]amino]-3-phenyl-1H-1,2,4-triazole-5-thione Formula: C24H22BrFN4O2S MolecularWeight: 529.424483

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CNN2C(=NNC2=S)C3=CC=CC=C3)Br)OCC4=CC=CC=C4F

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CNN2C(=NNC2=S)C3=CC=CC=C3)Br)OCC4=CC=CC=C4F

InChI

InChI=1S/C24H22BrFN4O2S/c1-2-31-21-13-16(12-19(25)22(21)32-15-18-10-6-7-11-20(18)26)14-27-30-23(28-29-24(30)33)17-8-4-3-5-9-17/h3-13,27H,2,14-15H2,1H3,(H,29,33)