2-[[4-azanyl-5-[(4-fluoranylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentyl-propanamide

Systemtic Name: 2-[[4-azanyl-5-[(4-fluoranylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentyl-propanamide Openeye Name: 2-[[4-amino-5-[(4-fluorophenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentyl-propanamide CAS Name: 2-[[4-amino-5-[(4-fluorophenoxy)methyl]-1,2,4-triazol-3-yl]thio]-N-cyclopentylpropanamide IUPAC Name: 2-[[4-amino-5-[(4-fluorophenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentylpropanamide Traditional Name: 2-[[4-amino-5-[(4-fluorophenoxy)methyl]-1,2,4-triazol-3-yl]thio]-N-cyclopentyl-propionamide Formula: C17H22FN5O2S MolecularWeight: 379.452283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)SC2=NN=C(N2N)COC3=CC=C(C=C3)F

Isomeric SMILES

CC(C(=O)NC1CCCC1)SC2=NN=C(N2N)COC3=CC=C(C=C3)F

InChI

InChI=1S/C17H22FN5O2S/c1-11(16(24)20-13-4-2-3-5-13)26-17-22-21-15(23(17)19)10-25-14-8-6-12(18)7-9-14/h6-9,11,13H,2-5,10,19H2,1H3,(H,20,24)