5-[1,3-bis(phenylmethyl)-1,3-diazinan-5-yl]-N-phenyl-1,2,3,4-tetrazole-2-carboxamide

Systemtic Name: 5-[1,3-bis(phenylmethyl)-1,3-diazinan-5-yl]-N-phenyl-1,2,3,4-tetrazole-2-carboxamide Openeye Name: 5-(1,3-dibenzylhexahydropyrimidin-5-yl)-N-phenyl-tetrazole-2-carboxamide CAS Name: 5-[1,3-bis(phenylmethyl)-1,3-diazinan-5-yl]-N-phenyl-2-tetrazolecarboxamide IUPAC Name: 5-(1,3-dibenzyl-1,3-diazinan-5-yl)-N-phenyltetrazole-2-carboxamide Traditional Name: 5-(1,3-dibenzylhexahydropyrimidin-5-yl)-N-phenyl-tetrazole-2-carboxamide Formula: C26H27N7O MolecularWeight: 453.53888

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(CN1CC2=CC=CC=C2)CC3=CC=CC=C3)C4=NN(N=N4)C(=O)NC5=CC=CC=C5

Isomeric SMILES

C1C(CN(CN1CC2=CC=CC=C2)CC3=CC=CC=C3)C4=NN(N=N4)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C26H27N7O/c34-26(27-24-14-8-3-9-15-24)33-29-25(28-30-33)23-18-31(16-21-10-4-1-5-11-21)20-32(19-23)17-22-12-6-2-7-13-22/h1-15,23H,16-20H2,(H,27,34)