2-cyclohexyl-4-[[4-(dimethylamino)-5-methyl-pyrimidin-2-yl]amino]-5-fluoranyl-benzamide hydrochloride

Systemtic Name: 2-cyclohexyl-4-[[4-(dimethylamino)-5-methyl-pyrimidin-2-yl]amino]-5-fluoranyl-benzamide hydrochloride Openeye Name: 2-cyclohexyl-4-[[4-(dimethylamino)-5-methyl-pyrimidin-2-yl]amino]-5-fluoro-benzamide hydrochloride CAS Name: 2-cyclohexyl-4-[[4-(dimethylamino)-5-methyl-2-pyrimidinyl]amino]-5-fluorobenzamide hydrochloride IUPAC Name: 2-cyclohexyl-4-[[4-(dimethylamino)-5-methylpyrimidin-2-yl]amino]-5-fluorobenzamide hydrochloride Traditional Name: 2-cyclohexyl-4-[[4-(dimethylamino)-5-methyl-pyrimidin-2-yl]amino]-5-fluoro-benzamide hydrochloride Formula: C20H27ClFN5O MolecularWeight: 407.912683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1N(C)C)NC2=C(C=C(C(=C2)C3CCCCC3)C(=O)N)F.Cl

Isomeric SMILES

CC1=CN=C(N=C1N(C)C)NC2=C(C=C(C(=C2)C3CCCCC3)C(=O)N)F.Cl

InChI

InChI=1S/C20H26FN5O.ClH/c1-12-11-23-20(25-19(12)26(2)3)24-17-10-14(13-7-5-4-6-8-13)15(18(22)27)9-16(17)21;/h9-11,13H,4-8H2,1-3H3,(H2,22,27)(H,23,24,25);1H