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

Systemtic Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-[4-(3-methoxyphenyl)piperazin-1-yl]ethanamide Openeye Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide CAS Name: N-[6-(2-acetamidoethylamino)-2-phenyl-4-pyrimidinyl]-2-[4-(3-methoxyphenyl)-1-piperazinyl]acetamide IUPAC Name: N-[6-(2-acetamidoethylamino)-2-phenylpyrimidin-4-yl]-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide Traditional Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-[4-(3-methoxyphenyl)piperazino]acetamide Formula: C27H33N7O3 MolecularWeight: 503.59602

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=NC(=NC(=C1)NC(=O)CN2CCN(CC2)C3=CC(=CC=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NCCNC1=NC(=NC(=C1)NC(=O)CN2CCN(CC2)C3=CC(=CC=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C27H33N7O3/c1-20(35)28-11-12-29-24-18-25(32-27(31-24)21-7-4-3-5-8-21)30-26(36)19-33-13-15-34(16-14-33)22-9-6-10-23(17-22)37-2/h3-10,17-18H,11-16,19H2,1-2H3,(H,28,35)(H2,29,30,31,32,36)