N-[4-[(2S)-2-[[1-(3-fluorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]propanoyl]phenyl]-2-methyl-propanamide

Systemtic Name: N-[4-[(2S)-2-[[1-(3-fluorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]propanoyl]phenyl]-2-methyl-propanamide Openeye Name: N-[4-[(2S)-2-[1-(3-fluorophenyl)tetrazol-5-yl]sulfanylpropanoyl]phenyl]-2-methyl-propanamide CAS Name: N-[4-[(2S)-2-[[1-(3-fluorophenyl)-5-tetrazolyl]thio]-1-oxopropyl]phenyl]-2-methylpropanamide IUPAC Name: N-[4-[(2S)-2-[1-(3-fluorophenyl)tetrazol-5-yl]sulfanylpropanoyl]phenyl]-2-methylpropanamide Traditional Name: N-[4-[(2S)-2-[[1-(3-fluorophenyl)tetrazol-5-yl]thio]propanoyl]phenyl]-2-methyl-propionamide Formula: C20H20FN5O2S MolecularWeight: 413.468503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)C(C)SC2=NN=NN2C3=CC(=CC=C3)F

Isomeric SMILES

C[C@@H](C(=O)C1=CC=C(C=C1)NC(=O)C(C)C)SC2=NN=NN2C3=CC(=CC=C3)F

InChI

InChI=1S/C20H20FN5O2S/c1-12(2)19(28)22-16-9-7-14(8-10-16)18(27)13(3)29-20-23-24-25-26(20)17-6-4-5-15(21)11-17/h4-13H,1-3H3,(H,22,28)/t13-/m0/s1