N-[2-[(4-chlorophenyl)methyl]pyrazol-3-yl]-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide

Systemtic Name: N-[2-[(4-chlorophenyl)methyl]pyrazol-3-yl]-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide Openeye Name: N-[2-[(4-chlorophenyl)methyl]pyrazol-3-yl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide CAS Name: N-[2-[(4-chlorophenyl)methyl]-3-pyrazolyl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide IUPAC Name: N-[2-[(4-chlorophenyl)methyl]pyrazol-3-yl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide Traditional Name: N-[2-(4-chlorobenzyl)pyrazol-3-yl]-4-(4-keto-1H-quinazolin-2-yl)butyramide Formula: C22H20ClN5O2 MolecularWeight: 421.8795

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20ClN5O2/c23-16-10-8-15(9-11-16)14-28-20(12-13-24-28)27-21(29)7-3-6-19-25-18-5-2-1-4-17(18)22(30)26-19/h1-2,4-5,8-13H,3,6-7,14H2,(H,27,29)(H,25,26,30)