2-chloranyl-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-5-methylsulfanyl-benzamide

Systemtic Name: 2-chloranyl-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-5-methylsulfanyl-benzamide Openeye Name: 2-chloro-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-5-methylsulfanyl-benzamide CAS Name: 2-chloro-N-[4-[[4-(dimethylamino)-2-pyrimidinyl]amino]cyclohexyl]-5-(methylthio)benzamide IUPAC Name: 2-chloro-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-5-methylsulfanylbenzamide Traditional Name: 2-chloro-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-5-(methylthio)benzamide Formula: C20H26ClN5OS MolecularWeight: 419.97134

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC=C1)NC2CCC(CC2)NC(=O)C3=C(C=CC(=C3)SC)Cl

Isomeric SMILES

CN(C)C1=NC(=NC=C1)NC2CCC(CC2)NC(=O)C3=C(C=CC(=C3)SC)Cl

InChI

InChI=1S/C20H26ClN5OS/c1-26(2)18-10-11-22-20(25-18)24-14-6-4-13(5-7-14)23-19(27)16-12-15(28-3)8-9-17(16)21/h8-14H,4-7H2,1-3H3,(H,23,27)(H,22,24,25)