4-(2-azanyl-5-fluoranyl-pyrimidin-4-yl)-3-(dimethylaminomethyl)-N-[(4-fluorophenyl)methyl]-5-methyl-1H-pyrrole-2-carboxamide

Systemtic Name: 4-(2-azanyl-5-fluoranyl-pyrimidin-4-yl)-3-(dimethylaminomethyl)-N-[(4-fluorophenyl)methyl]-5-methyl-1H-pyrrole-2-carboxamide Openeye Name: 4-(2-amino-5-fluoro-pyrimidin-4-yl)-3-(dimethylaminomethyl)-N-[(4-fluorophenyl)methyl]-5-methyl-1H-pyrrole-2-carboxamide CAS Name: 4-(2-amino-5-fluoro-4-pyrimidinyl)-3-(dimethylaminomethyl)-N-[(4-fluorophenyl)methyl]-5-methyl-1H-pyrrole-2-carboxamide IUPAC Name: 4-(2-amino-5-fluoropyrimidin-4-yl)-3-(dimethylaminomethyl)-N-[(4-fluorophenyl)methyl]-5-methyl-1H-pyrrole-2-carboxamide Traditional Name: 4-(2-amino-5-fluoro-pyrimidin-4-yl)-3-(dimethylaminomethyl)-N-(4-fluorobenzyl)-5-methyl-1H-pyrrole-2-carboxamide Formula: C20H22F2N6O MolecularWeight: 400.425086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C(=O)NCC2=CC=C(C=C2)F)CN(C)C)C3=NC(=NC=C3F)N

Isomeric SMILES

CC1=C(C(=C(N1)C(=O)NCC2=CC=C(C=C2)F)CN(C)C)C3=NC(=NC=C3F)N

InChI

InChI=1S/C20H22F2N6O/c1-11-16(18-15(22)9-25-20(23)27-18)14(10-28(2)3)17(26-11)19(29)24-8-12-4-6-13(21)7-5-12/h4-7,9,26H,8,10H2,1-3H3,(H,24,29)(H2,23,25,27)