4-chloranyl-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[4-[[4-(dimethylamino)-2-pyrimidinyl]amino]cyclohexyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-3-nitro-benzamide Formula: C19H23ClN6O3 MolecularWeight: 418.87732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23ClN6O3/c1-25(2)17-9-10-21-19(24-17)23-14-6-4-13(5-7-14)22-18(27)12-3-8-15(20)16(11-12)26(28)29/h3,8-11,13-14H,4-7H2,1-2H3,(H,22,27)(H,21,23,24)