4-isoquinolin-3-yl-1-methyl-N-[1-methyl-5-[[1-methyl-5-(2-morpholin-4-ylethylcarbamoyl)pyrrol-3-yl]carbamoyl]pyrrol-3-yl]pyrrole-2-carboxamide

Systemtic Name: 4-isoquinolin-3-yl-1-methyl-N-[1-methyl-5-[[1-methyl-5-(2-morpholin-4-ylethylcarbamoyl)pyrrol-3-yl]carbamoyl]pyrrol-3-yl]pyrrole-2-carboxamide Openeye Name: 4-(3-isoquinolyl)-1-methyl-N-[1-methyl-5-[[1-methyl-5-(2-morpholinoethylcarbamoyl)pyrrol-3-yl]carbamoyl]pyrrol-3-yl]pyrrole-2-carboxamide CAS Name: 4-(3-isoquinolinyl)-1-methyl-N-[1-methyl-5-[[[1-methyl-5-[[2-(4-morpholinyl)ethylamino]-oxomethyl]-3-pyrrolyl]amino]-oxomethyl]-3-pyrrolyl]-2-pyrrolecarboxamide IUPAC Name: 4-isoquinolin-3-yl-1-methyl-N-[1-methyl-5-[[1-methyl-5-(2-morpholin-4-ylethylcarbamoyl)pyrrol-3-yl]carbamoyl]pyrrol-3-yl]pyrrole-2-carboxamide Traditional Name: 4-(3-isoquinolyl)-1-methyl-N-[1-methyl-5-[[1-methyl-5-(2-morpholinoethylcarbamoyl)pyrrol-3-yl]carbamoyl]pyrrol-3-yl]pyrrole-2-carboxamide Formula: C33H36N8O4 MolecularWeight: 608.69014

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)NC3=CN(C(=C3)C(=O)NCCN4CCOCC4)C)C)C5=CC6=CC=CC=C6C=N5

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)NC3=CN(C(=C3)C(=O)NCCN4CCOCC4)C)C)C5=CC6=CC=CC=C6C=N5

InChI

InChI=1S/C33H36N8O4/c1-38-19-24(27-14-22-6-4-5-7-23(22)18-35-27)15-28(38)32(43)36-26-17-30(40(3)21-26)33(44)37-25-16-29(39(2)20-25)31(42)34-8-9-41-10-12-45-13-11-41/h4-7,14-21H,8-13H2,1-3H3,(H,34,42)(H,36,43)(H,37,44)