N-cyclobutyl-4-methyl-3-[4-oxidanylidene-6-(4-propan-2-ylpiperazin-1-yl)quinazolin-3-yl]benzamide

Systemtic Name: N-cyclobutyl-4-methyl-3-[4-oxidanylidene-6-(4-propan-2-ylpiperazin-1-yl)quinazolin-3-yl]benzamide Openeye Name: N-cyclobutyl-3-[6-(4-isopropylpiperazin-1-yl)-4-oxo-quinazolin-3-yl]-4-methyl-benzamide CAS Name: N-cyclobutyl-4-methyl-3-[4-oxo-6-(4-propan-2-yl-1-piperazinyl)-3-quinazolinyl]benzamide IUPAC Name: N-cyclobutyl-4-methyl-3-[4-oxo-6-(4-propan-2-ylpiperazin-1-yl)quinazolin-3-yl]benzamide Traditional Name: N-cyclobutyl-3-[6-(4-isopropylpiperazino)-4-keto-quinazolin-3-yl]-4-methyl-benzamide Formula: C27H33N5O2 MolecularWeight: 459.58322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CCC2)N3C=NC4=C(C3=O)C=C(C=C4)N5CCN(CC5)C(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CCC2)N3C=NC4=C(C3=O)C=C(C=C4)N5CCN(CC5)C(C)C

InChI

InChI=1S/C27H33N5O2/c1-18(2)30-11-13-31(14-12-30)22-9-10-24-23(16-22)27(34)32(17-28-24)25-15-20(8-7-19(25)3)26(33)29-21-5-4-6-21/h7-10,15-18,21H,4-6,11-14H2,1-3H3,(H,29,33)