propyl 5-methyl-7-(4-phenylmethoxyphenyl)-1,7-dihydro-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-6-carboxylate

Systemtic Name: propyl 5-methyl-7-(4-phenylmethoxyphenyl)-1,7-dihydro-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-6-carboxylate Openeye Name: propyl 7-(4-benzyloxyphenyl)-5-methyl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate CAS Name: 5-methyl-7-(4-phenylmethoxyphenyl)-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylic acid propyl ester IUPAC Name: propyl 5-methyl-7-(4-phenylmethoxyphenyl)-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate Traditional Name: 7-(4-benzoxyphenyl)-5-methyl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylic acid propyl ester Formula: C22H23N5O3 MolecularWeight: 405.44972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(N=C2N=NNN2C1C3=CC=C(C=C3)OCC4=CC=CC=C4)C

Isomeric SMILES

CCCOC(=O)C1=C(N=C2N=NNN2C1C3=CC=C(C=C3)OCC4=CC=CC=C4)C

InChI

InChI=1S/C22H23N5O3/c1-3-13-29-21(28)19-15(2)23-22-24-25-26-27(22)20(19)17-9-11-18(12-10-17)30-14-16-7-5-4-6-8-16/h4-12,20H,3,13-14H2,1-2H3,(H,23,24,26)