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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C(=O)CN2N=C(N=N2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)C(=O)CN2N=C(N=N2)C3=CC=CC=C3

InChI

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