N-[4-methyl-3-[6-(4-methylpiperazin-1-yl)-4-oxidanylidene-1H-quinazolin-2-yl]phenyl]-2-pyrrolidin-1-yl-pyridine-4-carboxamide

Systemtic Name: N-[4-methyl-3-[6-(4-methylpiperazin-1-yl)-4-oxidanylidene-1H-quinazolin-2-yl]phenyl]-2-pyrrolidin-1-yl-pyridine-4-carboxamide Openeye Name: N-[4-methyl-3-[6-(4-methylpiperazin-1-yl)-4-oxo-1H-quinazolin-2-yl]phenyl]-2-pyrrolidin-1-yl-pyridine-4-carboxamide CAS Name: N-[4-methyl-3-[6-(4-methyl-1-piperazinyl)-4-oxo-1H-quinazolin-2-yl]phenyl]-2-(1-pyrrolidinyl)-4-pyridinecarboxamide IUPAC Name: N-[4-methyl-3-[6-(4-methylpiperazin-1-yl)-4-oxo-1H-quinazolin-2-yl]phenyl]-2-pyrrolidin-1-ylpyridine-4-carboxamide Traditional Name: N-[3-[4-keto-6-(4-methylpiperazino)-1H-quinazolin-2-yl]-4-methyl-phenyl]-2-pyrrolidino-isonicotinamide Formula: C30H33N7O2 MolecularWeight: 523.62872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC=C2)N3CCCC3)C4=NC(=O)C5=C(N4)C=CC(=C5)N6CCN(CC6)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC=C2)N3CCCC3)C4=NC(=O)C5=C(N4)C=CC(=C5)N6CCN(CC6)C

InChI

InChI=1S/C30H33N7O2/c1-20-5-6-22(32-29(38)21-9-10-31-27(17-21)37-11-3-4-12-37)18-24(20)28-33-26-8-7-23(19-25(26)30(39)34-28)36-15-13-35(2)14-16-36/h5-10,17-19H,3-4,11-16H2,1-2H3,(H,32,38)(H,33,34,39)