4-[5-methyl-2-[(2-piperidin-1-ylquinazolin-4-yl)amino]pyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-[5-methyl-2-[(2-piperidin-1-ylquinazolin-4-yl)amino]pyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid Openeye Name: 4-[5-methyl-2-[[2-(1-piperidyl)quinazolin-4-yl]amino]pyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid CAS Name: 4-[5-methyl-2-[[2-(1-piperidinyl)-4-quinazolinyl]amino]-4-pyrimidinyl]-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-[5-methyl-2-[(2-piperidin-1-ylquinazolin-4-yl)amino]pyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid Traditional Name: 4-[5-methyl-2-[(2-piperidinoquinazolin-4-yl)amino]pyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid Formula: C23H23N7O2 MolecularWeight: 429.47442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1C2=CNC(=C2)C(=O)O)NC3=NC(=NC4=CC=CC=C43)N5CCCCC5

Isomeric SMILES

CC1=CN=C(N=C1C2=CNC(=C2)C(=O)O)NC3=NC(=NC4=CC=CC=C43)N5CCCCC5

InChI

InChI=1S/C23H23N7O2/c1-14-12-25-22(27-19(14)15-11-18(21(31)32)24-13-15)28-20-16-7-3-4-8-17(16)26-23(29-20)30-9-5-2-6-10-30/h3-4,7-8,11-13,24H,2,5-6,9-10H2,1H3,(H,31,32)(H,25,26,27,28,29)