N-[2-[[6-[4-(3-methoxy-2-oxidanyl-phenyl)carbonylpiperazin-1-yl]-2-phenyl-pyrimidin-4-yl]amino]ethyl]ethanamide

Systemtic Name: N-[2-[[6-[4-(3-methoxy-2-oxidanyl-phenyl)carbonylpiperazin-1-yl]-2-phenyl-pyrimidin-4-yl]amino]ethyl]ethanamide Openeye Name: N-[2-[[6-[4-(2-hydroxy-3-methoxy-benzoyl)piperazin-1-yl]-2-phenyl-pyrimidin-4-yl]amino]ethyl]acetamide CAS Name: N-[2-[[6-[4-[(2-hydroxy-3-methoxyphenyl)-oxomethyl]-1-piperazinyl]-2-phenyl-4-pyrimidinyl]amino]ethyl]acetamide IUPAC Name: N-[2-[[6-[4-(2-hydroxy-3-methoxybenzoyl)piperazin-1-yl]-2-phenylpyrimidin-4-yl]amino]ethyl]acetamide Traditional Name: N-[2-[[6-[4-(2-hydroxy-3-methoxy-benzoyl)piperazino]-2-phenyl-pyrimidin-4-yl]amino]ethyl]acetamide Formula: C26H30N6O4 MolecularWeight: 490.5542

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=NC(=NC(=C1)N2CCN(CC2)C(=O)C3=C(C(=CC=C3)OC)O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NCCNC1=NC(=NC(=C1)N2CCN(CC2)C(=O)C3=C(C(=CC=C3)OC)O)C4=CC=CC=C4

InChI

InChI=1S/C26H30N6O4/c1-18(33)27-11-12-28-22-17-23(30-25(29-22)19-7-4-3-5-8-19)31-13-15-32(16-14-31)26(35)20-9-6-10-21(36-2)24(20)34/h3-10,17,34H,11-16H2,1-2H3,(H,27,33)(H,28,29,30)