N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)butanamide

Systemtic Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)butanamide Openeye Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-4-(8-methyl-4-oxo-quinazolin-3-yl)butanamide CAS Name: N-[2-[(4-ethylphenyl)methyl]-3-pyrazolyl]-4-(8-methyl-4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-4-(8-methyl-4-oxoquinazolin-3-yl)butanamide Traditional Name: N-[2-(4-ethylbenzyl)pyrazol-3-yl]-4-(4-keto-8-methyl-quinazolin-3-yl)butyramide Formula: C25H27N5O2 MolecularWeight: 429.51418

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)CCCN3C=NC4=C(C3=O)C=CC=C4C

Isomeric SMILES

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)CCCN3C=NC4=C(C3=O)C=CC=C4C

InChI

InChI=1S/C25H27N5O2/c1-3-19-9-11-20(12-10-19)16-30-22(13-14-27-30)28-23(31)8-5-15-29-17-26-24-18(2)6-4-7-21(24)25(29)32/h4,6-7,9-14,17H,3,5,8,15-16H2,1-2H3,(H,28,31)