N-[4-[4-azanyl-7-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrrolo[2,3-d]pyrimidin-5-yl]-2-methoxy-phenyl]-2-(4-chloranylphenoxy)ethanamide

Systemtic Name: N-[4-[4-azanyl-7-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrrolo[2,3-d]pyrimidin-5-yl]-2-methoxy-phenyl]-2-(4-chloranylphenoxy)ethanamide Openeye Name: N-[4-[4-amino-7-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrrolo[2,3-d]pyrimidin-5-yl]-2-methoxy-phenyl]-2-(4-chlorophenoxy)acetamide CAS Name: N-[4-[4-amino-7-[4-(4-methyl-1-piperazinyl)cyclohexyl]-5-pyrrolo[2,3-d]pyrimidinyl]-2-methoxyphenyl]-2-(4-chlorophenoxy)acetamide IUPAC Name: N-[4-[4-amino-7-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrrolo[2,3-d]pyrimidin-5-yl]-2-methoxyphenyl]-2-(4-chlorophenoxy)acetamide Traditional Name: N-[4-[4-amino-7-[4-(4-methylpiperazino)cyclohexyl]pyrrolo[2,3-d]pyrimidin-5-yl]-2-methoxy-phenyl]-2-(4-chlorophenoxy)acetamide Formula: C32H38ClN7O3 MolecularWeight: 604.14222

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CCC(CC2)N3C=C(C4=C3N=CN=C4N)C5=CC(=C(C=C5)NC(=O)COC6=CC=C(C=C6)Cl)OC

Isomeric SMILES

CN1CCN(CC1)C2CCC(CC2)N3C=C(C4=C3N=CN=C4N)C5=CC(=C(C=C5)NC(=O)COC6=CC=C(C=C6)Cl)OC

InChI

InChI=1S/C32H38ClN7O3/c1-38-13-15-39(16-14-38)23-6-8-24(9-7-23)40-18-26(30-31(34)35-20-36-32(30)40)21-3-12-27(28(17-21)42-2)37-29(41)19-43-25-10-4-22(33)5-11-25/h3-5,10-12,17-18,20,23-24H,6-9,13-16,19H2,1-2H3,(H,37,41)(H2,34,35,36)