N-methyl-N-(phenylmethyl)-3-[(2-phenylquinazolin-4-yl)amino]-1H-1,2,4-triazole-5-carboxamide

Systemtic Name: N-methyl-N-(phenylmethyl)-3-[(2-phenylquinazolin-4-yl)amino]-1H-1,2,4-triazole-5-carboxamide Openeye Name: N-benzyl-N-methyl-3-[(2-phenylquinazolin-4-yl)amino]-1H-1,2,4-triazole-5-carboxamide CAS Name: N-methyl-N-(phenylmethyl)-3-[(2-phenyl-4-quinazolinyl)amino]-1H-1,2,4-triazole-5-carboxamide IUPAC Name: N-benzyl-N-methyl-3-[(2-phenylquinazolin-4-yl)amino]-1H-1,2,4-triazole-5-carboxamide Traditional Name: N-benzyl-N-methyl-3-[(2-phenylquinazolin-4-yl)amino]-1H-1,2,4-triazole-5-carboxamide Formula: C25H21N7O MolecularWeight: 435.48054

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)C2=NC(=NN2)NC3=NC(=NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)C2=NC(=NN2)NC3=NC(=NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C25H21N7O/c1-32(16-17-10-4-2-5-11-17)24(33)23-29-25(31-30-23)28-22-19-14-8-9-15-20(19)26-21(27-22)18-12-6-3-7-13-18/h2-15H,16H2,1H3,(H2,26,27,28,29,30,31)