6-[(4-azanyl-2-methyl-quinolin-6-yl)amino]-N-[4-(dimethylamino)-2-methyl-quinolin-6-yl]-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 6-[(4-azanyl-2-methyl-quinolin-6-yl)amino]-N-[4-(dimethylamino)-2-methyl-quinolin-6-yl]-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 6-[(4-amino-2-methyl-6-quinolyl)amino]-N-[4-(dimethylamino)-2-methyl-6-quinolyl]-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: 6-[(4-amino-2-methyl-6-quinolinyl)amino]-N-[4-(dimethylamino)-2-methyl-6-quinolinyl]-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 6-[(4-amino-2-methylquinolin-6-yl)amino]-N-[4-(dimethylamino)-2-methylquinolin-6-yl]-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 6-[(4-amino-2-methyl-6-quinolyl)amino]-N-[4-(dimethylamino)-2-methyl-6-quinolyl]-2-(methylthio)pyrimidine-4-carboxamide Formula: C28H28N8OS MolecularWeight: 524.63992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)NC3=NC(=NC(=C3)C(=O)NC4=CC5=C(C=C4)N=C(C=C5N(C)C)C)SC)C(=C1)N

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)NC3=NC(=NC(=C3)C(=O)NC4=CC5=C(C=C4)N=C(C=C5N(C)C)C)SC)C(=C1)N

InChI

InChI=1S/C28H28N8OS/c1-15-10-21(29)19-12-17(6-8-22(19)30-15)32-26-14-24(34-28(35-26)38-5)27(37)33-18-7-9-23-20(13-18)25(36(3)4)11-16(2)31-23/h6-14H,1-5H3,(H2,29,30)(H,33,37)(H,32,34,35)