N-cyclohexyl-2-[[5-nitro-2-[(3,4,5-trimethoxyphenyl)amino]pyrimidin-4-yl]amino]benzamide

Systemtic Name: N-cyclohexyl-2-[[5-nitro-2-[(3,4,5-trimethoxyphenyl)amino]pyrimidin-4-yl]amino]benzamide Openeye Name: N-cyclohexyl-2-[[5-nitro-2-(3,4,5-trimethoxyanilino)pyrimidin-4-yl]amino]benzamide CAS Name: N-cyclohexyl-2-[[5-nitro-2-(3,4,5-trimethoxyanilino)-4-pyrimidinyl]amino]benzamide IUPAC Name: N-cyclohexyl-2-[[5-nitro-2-(3,4,5-trimethoxyanilino)pyrimidin-4-yl]amino]benzamide Traditional Name: N-cyclohexyl-2-[[5-nitro-2-(3,4,5-trimethoxyanilino)pyrimidin-4-yl]amino]benzamide Formula: C26H30N6O6 MolecularWeight: 522.553

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC2=NC=C(C(=N2)NC3=CC=CC=C3C(=O)NC4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC2=NC=C(C(=N2)NC3=CC=CC=C3C(=O)NC4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C26H30N6O6/c1-36-21-13-17(14-22(37-2)23(21)38-3)29-26-27-15-20(32(34)35)24(31-26)30-19-12-8-7-11-18(19)25(33)28-16-9-5-4-6-10-16/h7-8,11-16H,4-6,9-10H2,1-3H3,(H,28,33)(H2,27,29,30,31)