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

Systemtic Name: 1-[[4-[(3-methylphenyl)methyl]piperazin-1-yl]methyl]-4-phenyl-1,2,3,4-tetrazol-5-one Openeye Name: 1-[[4-(m-tolylmethyl)piperazin-1-yl]methyl]-4-phenyl-tetrazol-5-one CAS Name: 1-[[4-[(3-methylphenyl)methyl]-1-piperazinyl]methyl]-4-phenyl-5-tetrazolone IUPAC Name: 1-[[4-[(3-methylphenyl)methyl]piperazin-1-yl]methyl]-4-phenyltetrazol-5-one Traditional Name: 1-[[4-(3-methylbenzyl)piperazino]methyl]-4-phenyl-tetrazol-5-one Formula: C20H24N6O MolecularWeight: 364.44416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)CN3C(=O)N(N=N3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)CN3C(=O)N(N=N3)C4=CC=CC=C4

InChI

InChI=1S/C20H24N6O/c1-17-6-5-7-18(14-17)15-23-10-12-24(13-11-23)16-25-20(27)26(22-21-25)19-8-3-2-4-9-19/h2-9,14H,10-13,15-16H2,1H3