(phenylmethyl) 5-methyl-7-[2-(4-methylpiperazin-1-yl)phenyl]-1,7-dihydro-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-6-carboxylate

Systemtic Name: (phenylmethyl) 5-methyl-7-[2-(4-methylpiperazin-1-yl)phenyl]-1,7-dihydro-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-6-carboxylate Openeye Name: benzyl 5-methyl-7-[2-(4-methylpiperazin-1-yl)phenyl]-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate CAS Name: 5-methyl-7-[2-(4-methyl-1-piperazinyl)phenyl]-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-methyl-7-[2-(4-methylpiperazin-1-yl)phenyl]-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate Traditional Name: 5-methyl-7-[2-(4-methylpiperazino)phenyl]-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylic acid benzyl ester Formula: C24H27N7O2 MolecularWeight: 445.51688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N2C(=N1)N=NN2)C3=CC=CC=C3N4CCN(CC4)C)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(N2C(=N1)N=NN2)C3=CC=CC=C3N4CCN(CC4)C)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C24H27N7O2/c1-17-21(23(32)33-16-18-8-4-3-5-9-18)22(31-24(25-17)26-27-28-31)19-10-6-7-11-20(19)30-14-12-29(2)13-15-30/h3-11,22H,12-16H2,1-2H3,(H,25,26,28)