2-cyclohexyl-4-[[4-(dimethylamino)-6-methyl-pyrimidin-2-yl]amino]-3-fluoranyl-benzamide hydrochloride

Systemtic Name: 2-cyclohexyl-4-[[4-(dimethylamino)-6-methyl-pyrimidin-2-yl]amino]-3-fluoranyl-benzamide hydrochloride Openeye Name: 2-cyclohexyl-4-[[4-(dimethylamino)-6-methyl-pyrimidin-2-yl]amino]-3-fluoro-benzamide hydrochloride CAS Name: 2-cyclohexyl-4-[[4-(dimethylamino)-6-methyl-2-pyrimidinyl]amino]-3-fluorobenzamide hydrochloride IUPAC Name: 2-cyclohexyl-4-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]amino]-3-fluorobenzamide hydrochloride Traditional Name: 2-cyclohexyl-4-[[4-(dimethylamino)-6-methyl-pyrimidin-2-yl]amino]-3-fluoro-benzamide hydrochloride Formula: C20H27ClFN5O MolecularWeight: 407.912683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=C(C(=C(C=C2)C(=O)N)C3CCCCC3)F)N(C)C.Cl

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=C(C(=C(C=C2)C(=O)N)C3CCCCC3)F)N(C)C.Cl

InChI

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