1-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanone

Systemtic Name: 1-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanone Openeye Name: 1-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-(5-phenyltetrazol-2-yl)ethanone CAS Name: 1-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-(5-phenyl-2-tetrazolyl)ethanone IUPAC Name: 1-(2,5-dimethyl-1-propylpyrrol-3-yl)-2-(5-phenyltetrazol-2-yl)ethanone Traditional Name: 1-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-(5-phenyltetrazol-2-yl)ethanone Formula: C18H21N5O MolecularWeight: 323.39224

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C(=O)CN2N=C(N=N2)C3=CC=CC=C3)C

Isomeric SMILES

CCCN1C(=CC(=C1C)C(=O)CN2N=C(N=N2)C3=CC=CC=C3)C

InChI

InChI=1S/C18H21N5O/c1-4-10-22-13(2)11-16(14(22)3)17(24)12-23-20-18(19-21-23)15-8-6-5-7-9-15/h5-9,11H,4,10,12H2,1-3H3