N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-[4-(3-oxidanylpropyl)piperazin-1-yl]ethanamide

Systemtic Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-[4-(3-oxidanylpropyl)piperazin-1-yl]ethanamide Openeye Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-[4-(3-hydroxypropyl)piperazin-1-yl]acetamide CAS Name: N-[6-(2-acetamidoethylamino)-2-phenyl-4-pyrimidinyl]-2-[4-(3-hydroxypropyl)-1-piperazinyl]acetamide IUPAC Name: N-[6-(2-acetamidoethylamino)-2-phenylpyrimidin-4-yl]-2-[4-(3-hydroxypropyl)piperazin-1-yl]acetamide Traditional Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-[4-(3-hydroxypropyl)piperazino]acetamide Formula: C23H33N7O3 MolecularWeight: 455.55322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=NC(=NC(=C1)NC(=O)CN2CCN(CC2)CCCO)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NCCNC1=NC(=NC(=C1)NC(=O)CN2CCN(CC2)CCCO)C3=CC=CC=C3

InChI

InChI=1S/C23H33N7O3/c1-18(32)24-8-9-25-20-16-21(28-23(27-20)19-6-3-2-4-7-19)26-22(33)17-30-13-11-29(12-14-30)10-5-15-31/h2-4,6-7,16,31H,5,8-15,17H2,1H3,(H,24,32)(H2,25,26,27,28,33)