3,3-diphenyl-1-[4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methyl]piperazin-1-yl]propan-1-one

Systemtic Name: 3,3-diphenyl-1-[4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methyl]piperazin-1-yl]propan-1-one Openeye Name: 3,3-diphenyl-1-[4-[(1-phenyltetrazol-5-yl)methyl]piperazin-1-yl]propan-1-one CAS Name: 3,3-diphenyl-1-[4-[(1-phenyl-5-tetrazolyl)methyl]-1-piperazinyl]-1-propanone IUPAC Name: 3,3-diphenyl-1-[4-[(1-phenyltetrazol-5-yl)methyl]piperazin-1-yl]propan-1-one Traditional Name: 3,3-diphenyl-1-[4-[(1-phenyltetrazol-5-yl)methyl]piperazino]propan-1-one Formula: C27H28N6O MolecularWeight: 452.55082

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NN=NN2C3=CC=CC=C3)C(=O)CC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=NN=NN2C3=CC=CC=C3)C(=O)CC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H28N6O/c34-27(20-25(22-10-4-1-5-11-22)23-12-6-2-7-13-23)32-18-16-31(17-19-32)21-26-28-29-30-33(26)24-14-8-3-9-15-24/h1-15,25H,16-21H2