ethyl 4-[[4-[2-(5H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methylamino]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[[4-[2-(5H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methylamino]pyrimidine-5-carboxylate Openeye Name: ethyl 4-[[4-[2-(5H-tetrazol-5-yl)phenyl]phenyl]methylamino]pyrimidine-5-carboxylate CAS Name: 4-[[4-[2-(5H-tetrazol-5-yl)phenyl]phenyl]methylamino]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-[2-(5H-tetrazol-5-yl)phenyl]phenyl]methylamino]pyrimidine-5-carboxylate Traditional Name: 4-[[4-[2-(5H-tetrazol-5-yl)phenyl]benzyl]amino]pyrimidine-5-carboxylic acid ethyl ester Formula: C21H19N7O2 MolecularWeight: 401.42126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=CN=C1NCC2=CC=C(C=C2)C3=CC=CC=C3C4N=NN=N4

Isomeric SMILES

CCOC(=O)C1=CN=CN=C1NCC2=CC=C(C=C2)C3=CC=CC=C3C4N=NN=N4

InChI

InChI=1S/C21H19N7O2/c1-2-30-21(29)18-12-22-13-24-19(18)23-11-14-7-9-15(10-8-14)16-5-3-4-6-17(16)20-25-27-28-26-20/h3-10,12-13,20H,2,11H2,1H3,(H,22,23,24)