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

Systemtic Name: N-[4-(dimethylamino)-2-methyl-quinolin-6-yl]-2-methylsulfanyl-6-(pyridin-4-ylamino)pyrimidine-4-carboxamide Openeye Name: N-[4-(dimethylamino)-2-methyl-6-quinolyl]-2-methylsulfanyl-6-(4-pyridylamino)pyrimidine-4-carboxamide CAS Name: N-[4-(dimethylamino)-2-methyl-6-quinolinyl]-2-(methylthio)-6-(pyridin-4-ylamino)-4-pyrimidinecarboxamide IUPAC Name: N-[4-(dimethylamino)-2-methylquinolin-6-yl]-2-methylsulfanyl-6-(pyridin-4-ylamino)pyrimidine-4-carboxamide Traditional Name: N-[4-(dimethylamino)-2-methyl-6-quinolyl]-2-(methylthio)-6-(4-pyridylamino)pyrimidine-4-carboxamide Formula: C23H23N7OS MolecularWeight: 445.54002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)NC(=O)C3=CC(=NC(=N3)SC)NC4=CC=NC=C4)C(=C1)N(C)C

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)NC(=O)C3=CC(=NC(=N3)SC)NC4=CC=NC=C4)C(=C1)N(C)C

InChI

InChI=1S/C23H23N7OS/c1-14-11-20(30(2)3)17-12-16(5-6-18(17)25-14)27-22(31)19-13-21(29-23(28-19)32-4)26-15-7-9-24-10-8-15/h5-13H,1-4H3,(H,27,31)(H,24,26,28,29)