2-[[5-[(4-fluoranylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-pentan-3-yl-ethanamide

Systemtic Name: 2-[[5-[(4-fluoranylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-pentan-3-yl-ethanamide Openeye Name: 2-[[4-allyl-5-[(4-fluorophenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(1-ethylpropyl)acetamide CAS Name: 2-[[5-[(4-fluorophenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-N-pentan-3-ylacetamide IUPAC Name: 2-[[5-[(4-fluorophenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-pentan-3-ylacetamide Traditional Name: 2-[[4-allyl-5-[(4-fluorophenoxy)methyl]-1,2,4-triazol-3-yl]thio]-N-(1-ethylpropyl)acetamide Formula: C19H25FN4O2S MolecularWeight: 392.490803

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)CSC1=NN=C(N1CC=C)COC2=CC=C(C=C2)F

Isomeric SMILES

CCC(CC)NC(=O)CSC1=NN=C(N1CC=C)COC2=CC=C(C=C2)F

InChI

InChI=1S/C19H25FN4O2S/c1-4-11-24-17(12-26-16-9-7-14(20)8-10-16)22-23-19(24)27-13-18(25)21-15(5-2)6-3/h4,7-10,15H,1,5-6,11-13H2,2-3H3,(H,21,25)