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

Systemtic Name: 4-[6-(4-bromophenyl)hexylamino]-N-[4-(diethylamino)-2-methyl-6-methylsulfanyl-pyrimidin-5-yl]butanamide Openeye Name: 4-[6-(4-bromophenyl)hexylamino]-N-[4-(diethylamino)-2-methyl-6-methylsulfanyl-pyrimidin-5-yl]butanamide CAS Name: 4-[6-(4-bromophenyl)hexylamino]-N-[4-(diethylamino)-2-methyl-6-(methylthio)-5-pyrimidinyl]butanamide IUPAC Name: 4-[6-(4-bromophenyl)hexylamino]-N-[4-(diethylamino)-2-methyl-6-methylsulfanylpyrimidin-5-yl]butanamide Traditional Name: 4-[6-(4-bromophenyl)hexylamino]-N-[4-(diethylamino)-2-methyl-6-(methylthio)pyrimidin-5-yl]butyramide Formula: C26H40BrN5OS MolecularWeight: 550.5977

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C(=NC(=N1)C)SC)NC(=O)CCCNCCCCCCC2=CC=C(C=C2)Br

Isomeric SMILES

CCN(CC)C1=C(C(=NC(=N1)C)SC)NC(=O)CCCNCCCCCCC2=CC=C(C=C2)Br

InChI

InChI=1S/C26H40BrN5OS/c1-5-32(6-2)25-24(26(34-4)30-20(3)29-25)31-23(33)13-11-19-28-18-10-8-7-9-12-21-14-16-22(27)17-15-21/h14-17,28H,5-13,18-19H2,1-4H3,(H,31,33)