N-[3-[8-[2,6-bis(fluoranyl)phenyl]-2-(dimethylamino)-7-oxidanylidene-5,6-dihydropyrimido[4,5-d]pyrimidin-4-yl]-4-methyl-phenyl]thiophene-3-carboxamide

Systemtic Name: N-[3-[8-[2,6-bis(fluoranyl)phenyl]-2-(dimethylamino)-7-oxidanylidene-5,6-dihydropyrimido[4,5-d]pyrimidin-4-yl]-4-methyl-phenyl]thiophene-3-carboxamide Openeye Name: N-[3-[8-(2,6-difluorophenyl)-2-(dimethylamino)-7-oxo-5,6-dihydropyrimido[4,5-d]pyrimidin-4-yl]-4-methyl-phenyl]thiophene-3-carboxamide CAS Name: N-[3-[8-(2,6-difluorophenyl)-2-(dimethylamino)-7-oxo-5,6-dihydropyrimido[4,5-d]pyrimidin-4-yl]-4-methylphenyl]-3-thiophenecarboxamide IUPAC Name: N-[3-[8-(2,6-difluorophenyl)-2-(dimethylamino)-7-oxo-5,6-dihydropyrimido[4,5-d]pyrimidin-4-yl]-4-methylphenyl]thiophene-3-carboxamide Traditional Name: N-[3-[8-(2,6-difluorophenyl)-2-(dimethylamino)-7-keto-5,6-dihydropyrimido[4,5-d]pyrimidin-4-yl]-4-methyl-phenyl]thiophene-3-carboxamide Formula: C26H22F2N6O2S MolecularWeight: 520.553686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CSC=C2)C3=C4CNC(=O)N(C4=NC(=N3)N(C)C)C5=C(C=CC=C5F)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CSC=C2)C3=C4CNC(=O)N(C4=NC(=N3)N(C)C)C5=C(C=CC=C5F)F

InChI

InChI=1S/C26H22F2N6O2S/c1-14-7-8-16(30-24(35)15-9-10-37-13-15)11-17(14)21-18-12-29-26(36)34(22-19(27)5-4-6-20(22)28)23(18)32-25(31-21)33(2)3/h4-11,13H,12H2,1-3H3,(H,29,36)(H,30,35)