N-[2-[[6-[4-(2-cyclohexylethyl)piperazin-1-yl]carbonyl-2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]ethyl]ethanamide

Systemtic Name: N-[2-[[6-[4-(2-cyclohexylethyl)piperazin-1-yl]carbonyl-2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]ethyl]ethanamide Openeye Name: N-[2-[[6-[4-(2-cyclohexylethyl)piperazine-1-carbonyl]-2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]ethyl]acetamide CAS Name: N-[2-[[6-[[4-(2-cyclohexylethyl)-1-piperazinyl]-oxomethyl]-2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]ethyl]acetamide IUPAC Name: N-[2-[[6-[4-(2-cyclohexylethyl)piperazine-1-carbonyl]-2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]ethyl]acetamide Traditional Name: N-[2-[[6-[4-(2-cyclohexylethyl)piperazine-1-carbonyl]-2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]ethyl]acetamide Formula: C29H39N7O2 MolecularWeight: 517.66566

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=NC(=NC2=C1C=C(N2)C(=O)N3CCN(CC3)CCC4CCCCC4)C5=CC=CC=C5

Isomeric SMILES

CC(=O)NCCNC1=NC(=NC2=C1C=C(N2)C(=O)N3CCN(CC3)CCC4CCCCC4)C5=CC=CC=C5

InChI

InChI=1S/C29H39N7O2/c1-21(37)30-13-14-31-27-24-20-25(32-28(24)34-26(33-27)23-10-6-3-7-11-23)29(38)36-18-16-35(17-19-36)15-12-22-8-4-2-5-9-22/h3,6-7,10-11,20,22H,2,4-5,8-9,12-19H2,1H3,(H,30,37)(H2,31,32,33,34)