4-[[6-(2-diethylaminoethylcarbamoylamino)pyrimidin-4-yl]amino]-N-(4-fluorophenyl)indole-1-carboxamide

Systemtic Name: 4-[[6-(2-diethylaminoethylcarbamoylamino)pyrimidin-4-yl]amino]-N-(4-fluorophenyl)indole-1-carboxamide Openeye Name: 4-[[6-(2-diethylaminoethylcarbamoylamino)pyrimidin-4-yl]amino]-N-(4-fluorophenyl)indole-1-carboxamide CAS Name: 4-[[6-[[(2-diethylaminoethylamino)-oxomethyl]amino]-4-pyrimidinyl]amino]-N-(4-fluorophenyl)-1-indolecarboxamide IUPAC Name: 4-[[6-(2-diethylaminoethylcarbamoylamino)pyrimidin-4-yl]amino]-N-(4-fluorophenyl)indole-1-carboxamide Traditional Name: 4-[[6-(2-diethylaminoethylcarbamoylamino)pyrimidin-4-yl]amino]-N-(4-fluorophenyl)indole-1-carboxamide Formula: C26H29FN8O2 MolecularWeight: 504.559263

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)NC1=NC=NC(=C1)NC2=CC=CC3=C2C=CN3C(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

CCN(CC)CCNC(=O)NC1=NC=NC(=C1)NC2=CC=CC3=C2C=CN3C(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C26H29FN8O2/c1-3-34(4-2)15-13-28-25(36)33-24-16-23(29-17-30-24)32-21-6-5-7-22-20(21)12-14-35(22)26(37)31-19-10-8-18(27)9-11-19/h5-12,14,16-17H,3-4,13,15H2,1-2H3,(H,31,37)(H3,28,29,30,32,33,36)