N2-[2-methoxy-4-(4-propan-2-ylpiperazin-1-yl)phenyl]-N4-quinolin-6-yl-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine

Systemtic Name: N2-[2-methoxy-4-(4-propan-2-ylpiperazin-1-yl)phenyl]-N4-quinolin-6-yl-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine Openeye Name: N2-[4-(4-isopropylpiperazin-1-yl)-2-methoxy-phenyl]-N4-(6-quinolyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine CAS Name: N2-[2-methoxy-4-(4-propan-2-yl-1-piperazinyl)phenyl]-N4-(6-quinolinyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine IUPAC Name: 2-N-[2-methoxy-4-(4-propan-2-ylpiperazin-1-yl)phenyl]-4-N-quinolin-6-yl-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine Traditional Name: [2-[4-(4-isopropylpiperazino)-2-methoxy-anilino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-(6-quinolyl)amine Formula: C29H32N8O MolecularWeight: 508.61738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C2=CC(=C(C=C2)NC3=NC4=C(C=CN4)C(=N3)NC5=CC6=C(C=C5)N=CC=C6)OC

Isomeric SMILES

CC(C)N1CCN(CC1)C2=CC(=C(C=C2)NC3=NC4=C(C=CN4)C(=N3)NC5=CC6=C(C=C5)N=CC=C6)OC

InChI

InChI=1S/C29H32N8O/c1-19(2)36-13-15-37(16-14-36)22-7-9-25(26(18-22)38-3)33-29-34-27-23(10-12-31-27)28(35-29)32-21-6-8-24-20(17-21)5-4-11-30-24/h4-12,17-19H,13-16H2,1-3H3,(H3,31,32,33,34,35)