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

Systemtic Name: N-[4-(diethylamino)-2-methyl-6-methylsulfanyl-pyrimidin-5-yl]-4-[methyl(phenyl)amino]butanamide Openeye Name: N-[4-(diethylamino)-2-methyl-6-methylsulfanyl-pyrimidin-5-yl]-4-(N-methylanilino)butanamide CAS Name: N-[4-(diethylamino)-2-methyl-6-(methylthio)-5-pyrimidinyl]-4-(N-methylanilino)butanamide IUPAC Name: N-[4-(diethylamino)-2-methyl-6-methylsulfanylpyrimidin-5-yl]-4-(N-methylanilino)butanamide Traditional Name: N-[4-(diethylamino)-2-methyl-6-(methylthio)pyrimidin-5-yl]-4-(N-methylanilino)butyramide Formula: C21H31N5OS MolecularWeight: 401.56874

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C(=NC(=N1)C)SC)NC(=O)CCCN(C)C2=CC=CC=C2

Isomeric SMILES

CCN(CC)C1=C(C(=NC(=N1)C)SC)NC(=O)CCCN(C)C2=CC=CC=C2

InChI

InChI=1S/C21H31N5OS/c1-6-26(7-2)20-19(21(28-5)23-16(3)22-20)24-18(27)14-11-15-25(4)17-12-9-8-10-13-17/h8-10,12-13H,6-7,11,14-15H2,1-5H3,(H,24,27)