7-cyclohexyl-6-[[4-[(4-methylpiperazin-1-yl)methyl]phenyl]methyl]pyrrolo[2,3-d]pyrimidine-2-carbonitrile

Systemtic Name: 7-cyclohexyl-6-[[4-[(4-methylpiperazin-1-yl)methyl]phenyl]methyl]pyrrolo[2,3-d]pyrimidine-2-carbonitrile Openeye Name: 7-cyclohexyl-6-[[4-[(4-methylpiperazin-1-yl)methyl]phenyl]methyl]pyrrolo[2,3-d]pyrimidine-2-carbonitrile CAS Name: 7-cyclohexyl-6-[[4-[(4-methyl-1-piperazinyl)methyl]phenyl]methyl]-2-pyrrolo[2,3-d]pyrimidinecarbonitrile IUPAC Name: 7-cyclohexyl-6-[[4-[(4-methylpiperazin-1-yl)methyl]phenyl]methyl]pyrrolo[2,3-d]pyrimidine-2-carbonitrile Traditional Name: 7-cyclohexyl-6-[4-[(4-methylpiperazino)methyl]benzyl]pyrrolo[2,3-d]pyrimidine-2-carbonitrile Formula: C26H32N6 MolecularWeight: 428.57248

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CC=C(C=C2)CC3=CC4=CN=C(N=C4N3C5CCCCC5)C#N

Isomeric SMILES

CN1CCN(CC1)CC2=CC=C(C=C2)CC3=CC4=CN=C(N=C4N3C5CCCCC5)C#N

InChI

InChI=1S/C26H32N6/c1-30-11-13-31(14-12-30)19-21-9-7-20(8-10-21)15-24-16-22-18-28-25(17-27)29-26(22)32(24)23-5-3-2-4-6-23/h7-10,16,18,23H,2-6,11-15,19H2,1H3