IUPAC: 4-[2-[bis[(4-methoxyphenyl)methyl]amino]pyrimidin-5-yl]-N-methyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-2-morpholin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidine-7-carboxamide

SMILES: COc1ccc(CN(Cc2ccc(OC)cc2)c2ncc(-c3nc(N4CCOCC4)nc4c3CCN4C(=O)N(C)c3ccc(N4CCN(C)CC4)cc3)cn2)cc1

Canonical SMILES: CN1CCN(CC1)C2=CC=C(C=C2)N(C)C(=O)N3CCC4=C(N=C(N=C43)N5CCOCC5)C6=CN=C(N=C6)N(CC7=CC=C(C=C7)OC)CC8=CC=C(C=C8)OC

الصيغة الجزيئية: C43H50N10O4

الوزن الجزيئي: 770.90

InChIKey: NTNMXRYBPFWOMM-UHFFFAOYSA-N

InChI:

InChI=1S/C43H50N10O4/c1-48-19-21-50(22-20-48)35-11-9-34(10-12-35)49(2)43(54)53-18-17-38-39(46-42(47-40(38)53)51-23-25-57-26-24-51)33-27-44-41(45-28-33)52(29-31-5-13-36(55-3)14-6-31)30-32-7-15-37(56-4)16-8-32/h5-16,27-28H,17-26,29-30H2,1-4H3

PubChem CID: 67386186 →

مرادفات

SCHEMBL2378692NTNMXRYBPFWOMM-UHFFFAOYSA-N4-{2-[bis-(4-methoxy-benzyl)-amino]-pyrimidin-5-yl}-2-morpholin-4-yl-5,6-dihydro-pyrrolo[2,3-d]pyrimidine-7-carboxylic acid methyl-[4-(4-methyl-piperazin-1-yl)-phenyl]-amide

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