2-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-(4-fluoranyl-3-nitro-phenyl)propanamide

Systemtic Name: 2-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-(4-fluoranyl-3-nitro-phenyl)propanamide Openeye Name: 2-(1-cyclopentyltetrazol-5-yl)sulfanyl-N-(4-fluoro-3-nitro-phenyl)propanamide CAS Name: 2-[(1-cyclopentyl-5-tetrazolyl)thio]-N-(4-fluoro-3-nitrophenyl)propanamide IUPAC Name: 2-(1-cyclopentyltetrazol-5-yl)sulfanyl-N-(4-fluoro-3-nitrophenyl)propanamide Traditional Name: 2-[(1-cyclopentyltetrazol-5-yl)thio]-N-(4-fluoro-3-nitro-phenyl)propionamide Formula: C15H17FN6O3S MolecularWeight: 380.397283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)F)[N+](=O)[O-])SC2=NN=NN2C3CCCC3

Isomeric SMILES

CC(C(=O)NC1=CC(=C(C=C1)F)[N+](=O)[O-])SC2=NN=NN2C3CCCC3

InChI

InChI=1S/C15H17FN6O3S/c1-9(26-15-18-19-20-21(15)11-4-2-3-5-11)14(23)17-10-6-7-12(16)13(8-10)22(24)25/h6-9,11H,2-5H2,1H3,(H,17,23)