2-cyano-4-(cyclohexylamino)-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]pyrimidine-5-carboxamide

Systemtic Name: 2-cyano-4-(cyclohexylamino)-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]pyrimidine-5-carboxamide Openeye Name: 2-cyano-4-(cyclohexylamino)-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]pyrimidine-5-carboxamide CAS Name: 2-cyano-4-(cyclohexylamino)-N-[2-[4-(4-methyl-1-piperazinyl)phenyl]ethyl]-5-pyrimidinecarboxamide IUPAC Name: 2-cyano-4-(cyclohexylamino)-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]pyrimidine-5-carboxamide Traditional Name: 2-cyano-4-(cyclohexylamino)-N-[2-[4-(4-methylpiperazino)phenyl]ethyl]pyrimidine-5-carboxamide Formula: C25H33N7O MolecularWeight: 447.57582

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=C(C=C2)CCNC(=O)C3=CN=C(N=C3NC4CCCCC4)C#N

Isomeric SMILES

CN1CCN(CC1)C2=CC=C(C=C2)CCNC(=O)C3=CN=C(N=C3NC4CCCCC4)C#N

InChI

InChI=1S/C25H33N7O/c1-31-13-15-32(16-14-31)21-9-7-19(8-10-21)11-12-27-25(33)22-18-28-23(17-26)30-24(22)29-20-5-3-2-4-6-20/h7-10,18,20H,2-6,11-16H2,1H3,(H,27,33)(H,28,29,30)