N-[1-(cyclohexylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-N-(4-methoxyphenyl)-2-(4-methylpiperazin-1-yl)-6-phenyl-pyrimidine-4-carboxamide

Systemtic Name: N-[1-(cyclohexylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-N-(4-methoxyphenyl)-2-(4-methylpiperazin-1-yl)-6-phenyl-pyrimidine-4-carboxamide Openeye Name: N-[1-(cyclohexylcarbamoyl)-3-methyl-butyl]-N-(4-methoxyphenyl)-2-(4-methylpiperazin-1-yl)-6-phenyl-pyrimidine-4-carboxamide CAS Name: N-[1-(cyclohexylamino)-4-methyl-1-oxopentan-2-yl]-N-(4-methoxyphenyl)-2-(4-methyl-1-piperazinyl)-6-phenyl-4-pyrimidinecarboxamide IUPAC Name: N-[1-(cyclohexylamino)-4-methyl-1-oxopentan-2-yl]-N-(4-methoxyphenyl)-2-(4-methylpiperazin-1-yl)-6-phenylpyrimidine-4-carboxamide Traditional Name: N-[1-(cyclohexylcarbamoyl)-3-methyl-butyl]-N-(4-methoxyphenyl)-2-(4-methylpiperazino)-6-phenyl-pyrimidine-4-carboxamide Formula: C35H46N6O3 MolecularWeight: 598.77814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1CCCCC1)N(C2=CC=C(C=C2)OC)C(=O)C3=NC(=NC(=C3)C4=CC=CC=C4)N5CCN(CC5)C

Isomeric SMILES

CC(C)CC(C(=O)NC1CCCCC1)N(C2=CC=C(C=C2)OC)C(=O)C3=NC(=NC(=C3)C4=CC=CC=C4)N5CCN(CC5)C

InChI

InChI=1S/C35H46N6O3/c1-25(2)23-32(33(42)36-27-13-9-6-10-14-27)41(28-15-17-29(44-4)18-16-28)34(43)31-24-30(26-11-7-5-8-12-26)37-35(38-31)40-21-19-39(3)20-22-40/h5,7-8,11-12,15-18,24-25,27,32H,6,9-10,13-14,19-23H2,1-4H3,(H,36,42)