9-oxidanylidene-N-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide

Systemtic Name: 9-oxidanylidene-N-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide Openeye Name: N-[(1-benzyl-3-phenyl-pyrazol-4-yl)methyl]-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide CAS Name: 9-oxo-N-[[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]methyl]-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide IUPAC Name: N-[(1-benzyl-3-phenylpyrazol-4-yl)methyl]-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide Traditional Name: N-[(1-benzyl-3-phenyl-pyrazol-4-yl)methyl]-9-keto-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide Formula: C29H25N5O2 MolecularWeight: 475.5411

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=NC3=C(C=CC(=C3)C(=O)NCC4=CN(N=C4C5=CC=CC=C5)CC6=CC=CC=C6)C(=O)N2C1

Isomeric SMILES

C1CC2=NC3=C(C=CC(=C3)C(=O)NCC4=CN(N=C4C5=CC=CC=C5)CC6=CC=CC=C6)C(=O)N2C1

InChI

InChI=1S/C29H25N5O2/c35-28(22-13-14-24-25(16-22)31-26-12-7-15-34(26)29(24)36)30-17-23-19-33(18-20-8-3-1-4-9-20)32-27(23)21-10-5-2-6-11-21/h1-6,8-11,13-14,16,19H,7,12,15,17-18H2,(H,30,35)