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

Systemtic Name: 2,3-diethyl-5-[[2-(pyrrolidin-1-ylcarbamoylamino)pyrimidin-4-yl]amino]indole-1-carboxamide Openeye Name: 2,3-diethyl-5-[[2-(pyrrolidin-1-ylcarbamoylamino)pyrimidin-4-yl]amino]indole-1-carboxamide CAS Name: 2,3-diethyl-5-[[2-[[oxo-(1-pyrrolidinylamino)methyl]amino]-4-pyrimidinyl]amino]-1-indolecarboxamide IUPAC Name: 2,3-diethyl-5-[[2-(pyrrolidin-1-ylcarbamoylamino)pyrimidin-4-yl]amino]indole-1-carboxamide Traditional Name: 2,3-diethyl-5-[[2-(pyrrolidinocarbamoylamino)pyrimidin-4-yl]amino]indole-1-carboxamide Formula: C22H28N8O2 MolecularWeight: 436.51012

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C2=C1C=C(C=C2)NC3=NC(=NC=C3)NC(=O)NN4CCCC4)C(=O)N)CC

Isomeric SMILES

CCC1=C(N(C2=C1C=C(C=C2)NC3=NC(=NC=C3)NC(=O)NN4CCCC4)C(=O)N)CC

InChI

InChI=1S/C22H28N8O2/c1-3-15-16-13-14(7-8-18(16)30(20(23)31)17(15)4-2)25-19-9-10-24-21(26-19)27-22(32)28-29-11-5-6-12-29/h7-10,13H,3-6,11-12H2,1-2H3,(H2,23,31)(H3,24,25,26,27,28,32)