N-[2-[[6-(4-cyclohex-3-en-1-ylcarbonylpiperazin-1-yl)-2-phenyl-pyrimidin-4-yl]amino]ethyl]ethanamide

Systemtic Name: N-[2-[[6-(4-cyclohex-3-en-1-ylcarbonylpiperazin-1-yl)-2-phenyl-pyrimidin-4-yl]amino]ethyl]ethanamide Openeye Name: N-[2-[[6-[4-(cyclohex-3-ene-1-carbonyl)piperazin-1-yl]-2-phenyl-pyrimidin-4-yl]amino]ethyl]acetamide CAS Name: N-[2-[[6-[4-[1-cyclohex-3-enyl(oxo)methyl]-1-piperazinyl]-2-phenyl-4-pyrimidinyl]amino]ethyl]acetamide IUPAC Name: N-[2-[[6-[4-(cyclohex-3-ene-1-carbonyl)piperazin-1-yl]-2-phenylpyrimidin-4-yl]amino]ethyl]acetamide Traditional Name: N-[2-[[6-[4-(cyclohex-3-ene-1-carbonyl)piperazino]-2-phenyl-pyrimidin-4-yl]amino]ethyl]acetamide Formula: C25H32N6O2 MolecularWeight: 448.56058

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=NC(=NC(=C1)N2CCN(CC2)C(=O)C3CCC=CC3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NCCNC1=NC(=NC(=C1)N2CCN(CC2)C(=O)C3CCC=CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H32N6O2/c1-19(32)26-12-13-27-22-18-23(29-24(28-22)20-8-4-2-5-9-20)30-14-16-31(17-15-30)25(33)21-10-6-3-7-11-21/h2-6,8-9,18,21H,7,10-17H2,1H3,(H,26,32)(H,27,28,29)