3-[6-(4-cyclobutylpiperazin-1-yl)-4-oxidanylidene-quinazolin-3-yl]-N-cyclopropyl-4-methyl-benzamide

Systemtic Name: 3-[6-(4-cyclobutylpiperazin-1-yl)-4-oxidanylidene-quinazolin-3-yl]-N-cyclopropyl-4-methyl-benzamide Openeye Name: 3-[6-(4-cyclobutylpiperazin-1-yl)-4-oxo-quinazolin-3-yl]-N-cyclopropyl-4-methyl-benzamide CAS Name: 3-[6-(4-cyclobutyl-1-piperazinyl)-4-oxo-3-quinazolinyl]-N-cyclopropyl-4-methylbenzamide IUPAC Name: 3-[6-(4-cyclobutylpiperazin-1-yl)-4-oxoquinazolin-3-yl]-N-cyclopropyl-4-methylbenzamide Traditional Name: 3-[6-(4-cyclobutylpiperazino)-4-keto-quinazolin-3-yl]-N-cyclopropyl-4-methyl-benzamide Formula: C27H31N5O2 MolecularWeight: 457.56734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=NC4=C(C3=O)C=C(C=C4)N5CCN(CC5)C6CCC6

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=NC4=C(C3=O)C=C(C=C4)N5CCN(CC5)C6CCC6

InChI

InChI=1S/C27H31N5O2/c1-18-5-6-19(26(33)29-20-7-8-20)15-25(18)32-17-28-24-10-9-22(16-23(24)27(32)34)31-13-11-30(12-14-31)21-3-2-4-21/h5-6,9-10,15-17,20-21H,2-4,7-8,11-14H2,1H3,(H,29,33)