N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-4-oxidanylidene-pentanamide

Systemtic Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-4-oxidanylidene-pentanamide Openeye Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-4-oxo-pentanamide CAS Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-4-pyrimidinyl]amino]ethyl]-4-oxopentanamide IUPAC Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenylpyrimidin-4-yl]amino]ethyl]-4-oxopentanamide Traditional Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-4-keto-valeramide Formula: C22H30N6O3 MolecularWeight: 426.512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1NCCNC(=O)CCC(=O)C)C2=CC=CC=C2)NCCNC(=O)C

Isomeric SMILES

CC1=C(N=C(N=C1NCCNC(=O)CCC(=O)C)C2=CC=CC=C2)NCCNC(=O)C

InChI

InChI=1S/C22H30N6O3/c1-15(29)9-10-19(31)24-12-14-26-21-16(2)20(25-13-11-23-17(3)30)27-22(28-21)18-7-5-4-6-8-18/h4-8H,9-14H2,1-3H3,(H,23,30)(H,24,31)(H2,25,26,27,28)