N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N,1-bis(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N,1-bis(phenylmethyl)pyrazole-4-carboxamide Openeye Name: N,1-dibenzyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]pyrazole-4-carboxamide CAS Name: N-[(4-oxo-1H-quinazolin-2-yl)methyl]-N,1-bis(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: N,1-dibenzyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]pyrazole-4-carboxamide Traditional Name: N,1-dibenzyl-N-[(4-keto-1H-quinazolin-2-yl)methyl]pyrazole-4-carboxamide Formula: C27H23N5O2 MolecularWeight: 449.50382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C=N2)C(=O)N(CC3=CC=CC=C3)CC4=NC(=O)C5=CC=CC=C5N4

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C=N2)C(=O)N(CC3=CC=CC=C3)CC4=NC(=O)C5=CC=CC=C5N4

InChI

InChI=1S/C27H23N5O2/c33-26-23-13-7-8-14-24(23)29-25(30-26)19-31(16-20-9-3-1-4-10-20)27(34)22-15-28-32(18-22)17-21-11-5-2-6-12-21/h1-15,18H,16-17,19H2,(H,29,30,33)