N-[2-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide

Systemtic Name: N-[2-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide Openeye Name: N-[2-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-[2-[(2,4-dichlorophenyl)methyl]-3-pyrazolyl]-4-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-[2-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: N-[2-(2,4-dichlorobenzyl)pyrazol-3-yl]-4-(4-ketoquinazolin-3-yl)butyramide Formula: C22H19Cl2N5O2 MolecularWeight: 456.32456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CCCC(=O)NC3=CC=NN3CC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CCCC(=O)NC3=CC=NN3CC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H19Cl2N5O2/c23-16-8-7-15(18(24)12-16)13-29-20(9-10-26-29)27-21(30)6-3-11-28-14-25-19-5-2-1-4-17(19)22(28)31/h1-2,4-5,7-10,12,14H,3,6,11,13H2,(H,27,30)