1-(4-methylpiperazin-1-yl)-4-(1-phenyl-1,2,3,4-tetrazol-5-yl)butan-1-one

Systemtic Name: 1-(4-methylpiperazin-1-yl)-4-(1-phenyl-1,2,3,4-tetrazol-5-yl)butan-1-one Openeye Name: 1-(4-methylpiperazin-1-yl)-4-(1-phenyltetrazol-5-yl)butan-1-one CAS Name: 1-(4-methyl-1-piperazinyl)-4-(1-phenyl-5-tetrazolyl)-1-butanone IUPAC Name: 1-(4-methylpiperazin-1-yl)-4-(1-phenyltetrazol-5-yl)butan-1-one Traditional Name: 1-(4-methylpiperazino)-4-(1-phenyltetrazol-5-yl)butan-1-one Formula: C16H22N6O MolecularWeight: 314.38548

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CCCC2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

CN1CCN(CC1)C(=O)CCCC2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C16H22N6O/c1-20-10-12-21(13-11-20)16(23)9-5-8-15-17-18-19-22(15)14-6-3-2-4-7-14/h2-4,6-7H,5,8-13H2,1H3