3-(4-chlorophenyl)-N-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: 3-(4-chlorophenyl)-N-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-3-(4-chlorophenyl)-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]pyrazole-4-carboxamide CAS Name: 3-(4-chlorophenyl)-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-3-(4-chlorophenyl)-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]pyrazole-4-carboxamide Traditional Name: 1-benzyl-3-(4-chlorophenyl)-N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-methyl-pyrazole-4-carboxamide Formula: C27H22ClN5O2 MolecularWeight: 483.94888

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CN(N=C3C4=CC=C(C=C4)Cl)CC5=CC=CC=C5

Isomeric SMILES

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CN(N=C3C4=CC=C(C=C4)Cl)CC5=CC=CC=C5

InChI

InChI=1S/C27H22ClN5O2/c1-32(17-24-29-23-10-6-5-9-21(23)26(34)30-24)27(35)22-16-33(15-18-7-3-2-4-8-18)31-25(22)19-11-13-20(28)14-12-19/h2-14,16H,15,17H2,1H3,(H,29,30,34)