2-[[4-azanyl-5-[2,4-bis(chloranyl)-5-fluoranyl-phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(4-fluorophenyl)ethanamide

Systemtic Name: 2-[[4-azanyl-5-[2,4-bis(chloranyl)-5-fluoranyl-phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(4-fluorophenyl)ethanamide Openeye Name: 2-[[4-amino-5-(2,4-dichloro-5-fluoro-phenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-fluorophenyl)acetamide CAS Name: 2-[[4-amino-5-(2,4-dichloro-5-fluorophenyl)-1,2,4-triazol-3-yl]thio]-N-(4-fluorophenyl)acetamide IUPAC Name: 2-[[4-amino-5-(2,4-dichloro-5-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-fluorophenyl)acetamide Traditional Name: 2-[[4-amino-5-(2,4-dichloro-5-fluoro-phenyl)-1,2,4-triazol-3-yl]thio]-N-(4-fluorophenyl)acetamide Formula: C16H11Cl2F2N5OS MolecularWeight: 430.259246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CSC2=NN=C(N2N)C3=CC(=C(C=C3Cl)Cl)F)F

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CSC2=NN=C(N2N)C3=CC(=C(C=C3Cl)Cl)F)F

InChI

InChI=1S/C16H11Cl2F2N5OS/c17-11-6-12(18)13(20)5-10(11)15-23-24-16(25(15)21)27-7-14(26)22-9-3-1-8(19)2-4-9/h1-6H,7,21H2,(H,22,26)