N-ethyl-2-methylsulfanyl-4-[(4-morpholin-4-ylphenyl)amino]-N-(pyridin-4-ylmethyl)pyrimidine-5-carboxamide

Systemtic Name: N-ethyl-2-methylsulfanyl-4-[(4-morpholin-4-ylphenyl)amino]-N-(pyridin-4-ylmethyl)pyrimidine-5-carboxamide Openeye Name: N-ethyl-2-methylsulfanyl-4-(4-morpholinoanilino)-N-(4-pyridylmethyl)pyrimidine-5-carboxamide CAS Name: N-ethyl-2-(methylthio)-4-[4-(4-morpholinyl)anilino]-N-(pyridin-4-ylmethyl)-5-pyrimidinecarboxamide IUPAC Name: N-ethyl-2-methylsulfanyl-4-(4-morpholin-4-ylanilino)-N-(pyridin-4-ylmethyl)pyrimidine-5-carboxamide Traditional Name: N-ethyl-2-(methylthio)-4-(4-morpholinoanilino)-N-(4-pyridylmethyl)pyrimidine-5-carboxamide Formula: C24H28N6O2S MolecularWeight: 464.58312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=NC=C1)C(=O)C2=CN=C(N=C2NC3=CC=C(C=C3)N4CCOCC4)SC

Isomeric SMILES

CCN(CC1=CC=NC=C1)C(=O)C2=CN=C(N=C2NC3=CC=C(C=C3)N4CCOCC4)SC

InChI

InChI=1S/C24H28N6O2S/c1-3-29(17-18-8-10-25-11-9-18)23(31)21-16-26-24(33-2)28-22(21)27-19-4-6-20(7-5-19)30-12-14-32-15-13-30/h4-11,16H,3,12-15,17H2,1-2H3,(H,26,27,28)