4-[hexyl(phenyl)amino]-N-(2-methyl-4-methylsulfanyl-6-morpholin-4-yl-pyrimidin-5-yl)butanamide

Systemtic Name: 4-[hexyl(phenyl)amino]-N-(2-methyl-4-methylsulfanyl-6-morpholin-4-yl-pyrimidin-5-yl)butanamide Openeye Name: 4-(N-hexylanilino)-N-(2-methyl-4-methylsulfanyl-6-morpholino-pyrimidin-5-yl)butanamide CAS Name: 4-(N-hexylanilino)-N-[2-methyl-4-(methylthio)-6-(4-morpholinyl)-5-pyrimidinyl]butanamide IUPAC Name: 4-(N-hexylanilino)-N-(2-methyl-4-methylsulfanyl-6-morpholin-4-ylpyrimidin-5-yl)butanamide Traditional Name: 4-(N-hexylanilino)-N-[2-methyl-4-(methylthio)-6-morpholino-pyrimidin-5-yl]butyramide Formula: C26H39N5O2S MolecularWeight: 485.68516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCC(=O)NC1=C(N=C(N=C1SC)C)N2CCOCC2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCN(CCCC(=O)NC1=C(N=C(N=C1SC)C)N2CCOCC2)C3=CC=CC=C3

InChI

InChI=1S/C26H39N5O2S/c1-4-5-6-10-15-30(22-12-8-7-9-13-22)16-11-14-23(32)29-24-25(31-17-19-33-20-18-31)27-21(2)28-26(24)34-3/h7-9,12-13H,4-6,10-11,14-20H2,1-3H3,(H,29,32)