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

Systemtic Name: 3-acetamido-N-[4-methyl-3-[6-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinazolin-3-yl]phenyl]benzamide Openeye Name: 3-acetamido-N-[4-methyl-3-[6-(4-methylpiperazin-1-yl)-4-oxo-quinazolin-3-yl]phenyl]benzamide CAS Name: 3-acetamido-N-[4-methyl-3-[6-(4-methyl-1-piperazinyl)-4-oxo-3-quinazolinyl]phenyl]benzamide IUPAC Name: 3-acetamido-N-[4-methyl-3-[6-(4-methylpiperazin-1-yl)-4-oxoquinazolin-3-yl]phenyl]benzamide Traditional Name: 3-acetamido-N-[3-[4-keto-6-(4-methylpiperazino)quinazolin-3-yl]-4-methyl-phenyl]benzamide Formula: C29H30N6O3 MolecularWeight: 510.5869

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)NC(=O)C)N3C=NC4=C(C3=O)C=C(C=C4)N5CCN(CC5)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)NC(=O)C)N3C=NC4=C(C3=O)C=C(C=C4)N5CCN(CC5)C

InChI

InChI=1S/C29H30N6O3/c1-19-7-8-23(32-28(37)21-5-4-6-22(15-21)31-20(2)36)16-27(19)35-18-30-26-10-9-24(17-25(26)29(35)38)34-13-11-33(3)12-14-34/h4-10,15-18H,11-14H2,1-3H3,(H,31,36)(H,32,37)