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

Systemtic Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-2-(2-nitrophenyl)ethanamide Openeye Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-2-(2-nitrophenyl)acetamide CAS Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-4-pyrimidinyl]amino]ethyl]-2-(2-nitrophenyl)acetamide IUPAC Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenylpyrimidin-4-yl]amino]ethyl]-2-(2-nitrophenyl)acetamide Traditional Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-2-(2-nitrophenyl)acetamide Formula: C25H29N7O4 MolecularWeight: 491.54226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1NCCNC(=O)CC2=CC=CC=C2[N+](=O)[O-])C3=CC=CC=C3)NCCNC(=O)C

Isomeric SMILES

CC1=C(N=C(N=C1NCCNC(=O)CC2=CC=CC=C2[N+](=O)[O-])C3=CC=CC=C3)NCCNC(=O)C

InChI

InChI=1S/C25H29N7O4/c1-17-23(28-14-12-26-18(2)33)30-25(19-8-4-3-5-9-19)31-24(17)29-15-13-27-22(34)16-20-10-6-7-11-21(20)32(35)36/h3-11H,12-16H2,1-2H3,(H,26,33)(H,27,34)(H2,28,29,30,31)