2-chloranyl-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[4-[[4-(dimethylamino)-2-pyrimidinyl]amino]cyclohexyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-4-nitro-benzamide Formula: C19H23ClN6O3 MolecularWeight: 418.87732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC=C1)NC2CCC(CC2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CN(C)C1=NC(=NC=C1)NC2CCC(CC2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H23ClN6O3/c1-25(2)17-9-10-21-19(24-17)23-13-5-3-12(4-6-13)22-18(27)15-8-7-14(26(28)29)11-16(15)20/h7-13H,3-6H2,1-2H3,(H,22,27)(H,21,23,24)