2-[(4-azanyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2-fluorophenyl)methyl]-N-methyl-ethanamide

Systemtic Name: 2-[(4-azanyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2-fluorophenyl)methyl]-N-methyl-ethanamide Openeye Name: 2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(2-fluorophenyl)methyl]-N-methyl-acetamide CAS Name: 2-[[4-amino-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-N-[(2-fluorophenyl)methyl]-N-methylacetamide IUPAC Name: 2-[(4-amino-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2-fluorophenyl)methyl]-N-methylacetamide Traditional Name: 2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-(2-fluorobenzyl)-N-methyl-acetamide Formula: C17H17FN6OS MolecularWeight: 372.419883

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1F)C(=O)CSC2=NN=C(N2N)C3=CN=CC=C3

Isomeric SMILES

CN(CC1=CC=CC=C1F)C(=O)CSC2=NN=C(N2N)C3=CN=CC=C3

InChI

InChI=1S/C17H17FN6OS/c1-23(10-13-5-2-3-7-14(13)18)15(25)11-26-17-22-21-16(24(17)19)12-6-4-8-20-9-12/h2-9H,10-11,19H2,1H3