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

Systemtic Name: N-cyclobutyl-4-methyl-3-[6-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinazolin-3-yl]benzamide Openeye Name: N-cyclobutyl-4-methyl-3-[6-(4-methylpiperazin-1-yl)-4-oxo-quinazolin-3-yl]benzamide CAS Name: N-cyclobutyl-4-methyl-3-[6-(4-methyl-1-piperazinyl)-4-oxo-3-quinazolinyl]benzamide IUPAC Name: N-cyclobutyl-4-methyl-3-[6-(4-methylpiperazin-1-yl)-4-oxoquinazolin-3-yl]benzamide Traditional Name: N-cyclobutyl-3-[4-keto-6-(4-methylpiperazino)quinazolin-3-yl]-4-methyl-benzamide Formula: C25H29N5O2 MolecularWeight: 431.53006

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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

Isomeric SMILES

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

InChI

InChI=1S/C25H29N5O2/c1-17-6-7-18(24(31)27-19-4-3-5-19)14-23(17)30-16-26-22-9-8-20(15-21(22)25(30)32)29-12-10-28(2)11-13-29/h6-9,14-16,19H,3-5,10-13H2,1-2H3,(H,27,31)