2-(5-phenyl-1,2,3,4-tetrazol-2-yl)-N-propyl-ethanamide

Systemtic Name: 2-(5-phenyl-1,2,3,4-tetrazol-2-yl)-N-propyl-ethanamide Openeye Name: 2-(5-phenyltetrazol-2-yl)-N-propyl-acetamide CAS Name: 2-(5-phenyl-2-tetrazolyl)-N-propylacetamide IUPAC Name: 2-(5-phenyltetrazol-2-yl)-N-propylacetamide Traditional Name: 2-(5-phenyltetrazol-2-yl)-N-propyl-acetamide Formula: C12H15N5O MolecularWeight: 245.2804

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN1N=C(N=N1)C2=CC=CC=C2

Isomeric SMILES

CCCNC(=O)CN1N=C(N=N1)C2=CC=CC=C2

InChI

InChI=1S/C12H15N5O/c1-2-8-13-11(18)9-17-15-12(14-16-17)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,13,18)