6-[[6-[3-(diethylamino)propylcarbamoylamino]pyrimidin-4-yl]amino]-N-(4-fluorophenyl)indole-1-carboxamide

Systemtic Name: 6-[[6-[3-(diethylamino)propylcarbamoylamino]pyrimidin-4-yl]amino]-N-(4-fluorophenyl)indole-1-carboxamide Openeye Name: 6-[[6-[3-(diethylamino)propylcarbamoylamino]pyrimidin-4-yl]amino]-N-(4-fluorophenyl)indole-1-carboxamide CAS Name: 6-[[6-[[[3-(diethylamino)propylamino]-oxomethyl]amino]-4-pyrimidinyl]amino]-N-(4-fluorophenyl)-1-indolecarboxamide IUPAC Name: 6-[[6-[3-(diethylamino)propylcarbamoylamino]pyrimidin-4-yl]amino]-N-(4-fluorophenyl)indole-1-carboxamide Traditional Name: 6-[[6-[3-(diethylamino)propylcarbamoylamino]pyrimidin-4-yl]amino]-N-(4-fluorophenyl)indole-1-carboxamide Formula: C27H31FN8O2 MolecularWeight: 518.585843

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC(=O)NC1=NC=NC(=C1)NC2=CC3=C(C=C2)C=CN3C(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

CCN(CC)CCCNC(=O)NC1=NC=NC(=C1)NC2=CC3=C(C=C2)C=CN3C(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C27H31FN8O2/c1-3-35(4-2)14-5-13-29-26(37)34-25-17-24(30-18-31-25)32-22-9-6-19-12-15-36(23(19)16-22)27(38)33-21-10-7-20(28)8-11-21/h6-12,15-18H,3-5,13-14H2,1-2H3,(H,33,38)(H3,29,30,31,32,34,37)