2-[5-(4-bromophenyl)-1,2,3,4-tetrazol-2-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one

Systemtic Name: 2-[5-(4-bromophenyl)-1,2,3,4-tetrazol-2-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: 2-[5-(4-bromophenyl)tetrazol-2-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: 2-[5-(4-bromophenyl)-2-tetrazolyl]-1-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: 2-[5-(4-bromophenyl)tetrazol-2-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: 2-[5-(4-bromophenyl)tetrazol-2-yl]-1-(4-phenylpiperazino)propan-1-one Formula: C20H21BrN6O MolecularWeight: 441.32434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)N3N=C(N=N3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)N3N=C(N=N3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H21BrN6O/c1-15(27-23-19(22-24-27)16-7-9-17(21)10-8-16)20(28)26-13-11-25(12-14-26)18-5-3-2-4-6-18/h2-10,15H,11-14H2,1H3