N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-2-(4-oxidanylidenequinazolin-3-yl)ethanamide

Systemtic Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-2-(4-oxidanylidenequinazolin-3-yl)ethanamide Openeye Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-2-(4-oxoquinazolin-3-yl)acetamide CAS Name: N-[2-[(4-ethylphenyl)methyl]-3-pyrazolyl]-2-(4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-2-(4-oxoquinazolin-3-yl)acetamide Traditional Name: N-[2-(4-ethylbenzyl)pyrazol-3-yl]-2-(4-ketoquinazolin-3-yl)acetamide Formula: C22H21N5O2 MolecularWeight: 387.43444

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)CN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)CN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C22H21N5O2/c1-2-16-7-9-17(10-8-16)13-27-20(11-12-24-27)25-21(28)14-26-15-23-19-6-4-3-5-18(19)22(26)29/h3-12,15H,2,13-14H2,1H3,(H,25,28)