N-[(2S)-heptan-2-yl]-2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanamide

Systemtic Name: N-[(2S)-heptan-2-yl]-2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanamide Openeye Name: N-[(1S)-1-methylhexyl]-2-(5-phenyltetrazol-2-yl)acetamide CAS Name: N-[(2S)-heptan-2-yl]-2-(5-phenyl-2-tetrazolyl)acetamide IUPAC Name: N-[(2S)-heptan-2-yl]-2-(5-phenyltetrazol-2-yl)acetamide Traditional Name: N-[(1S)-1-methylhexyl]-2-(5-phenyltetrazol-2-yl)acetamide Formula: C16H23N5O MolecularWeight: 301.38672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)CN1N=C(N=N1)C2=CC=CC=C2

Isomeric SMILES

CCCCC[C@H](C)NC(=O)CN1N=C(N=N1)C2=CC=CC=C2

InChI

InChI=1S/C16H23N5O/c1-3-4-6-9-13(2)17-15(22)12-21-19-16(18-20-21)14-10-7-5-8-11-14/h5,7-8,10-11,13H,3-4,6,9,12H2,1-2H3,(H,17,22)/t13-/m0/s1