2,3-diethyl-5-[[5-iodanyl-2-(pyrrolidin-1-ylcarbamoylamino)pyrimidin-4-yl]amino]indole-1-carboxamide

Systemtic Name: 2,3-diethyl-5-[[5-iodanyl-2-(pyrrolidin-1-ylcarbamoylamino)pyrimidin-4-yl]amino]indole-1-carboxamide Openeye Name: 2,3-diethyl-5-[[5-iodo-2-(pyrrolidin-1-ylcarbamoylamino)pyrimidin-4-yl]amino]indole-1-carboxamide CAS Name: 2,3-diethyl-5-[[5-iodo-2-[[oxo-(1-pyrrolidinylamino)methyl]amino]-4-pyrimidinyl]amino]-1-indolecarboxamide IUPAC Name: 2,3-diethyl-5-[[5-iodo-2-(pyrrolidin-1-ylcarbamoylamino)pyrimidin-4-yl]amino]indole-1-carboxamide Traditional Name: 2,3-diethyl-5-[[5-iodo-2-(pyrrolidinocarbamoylamino)pyrimidin-4-yl]amino]indole-1-carboxamide Formula: C22H27IN8O2 MolecularWeight: 562.40665

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C2=C1C=C(C=C2)NC3=NC(=NC=C3I)NC(=O)NN4CCCC4)C(=O)N)CC

Isomeric SMILES

CCC1=C(N(C2=C1C=C(C=C2)NC3=NC(=NC=C3I)NC(=O)NN4CCCC4)C(=O)N)CC

InChI

InChI=1S/C22H27IN8O2/c1-3-14-15-11-13(7-8-18(15)31(20(24)32)17(14)4-2)26-19-16(23)12-25-21(27-19)28-22(33)29-30-9-5-6-10-30/h7-8,11-12H,3-6,9-10H2,1-2H3,(H2,24,32)(H3,25,26,27,28,29,33)