2-cyclohexyl-4-[[4-(dimethylamino)-5-methyl-pyrimidin-2-yl]amino]-3-methyl-benzamide hydrochloride

Systemtic Name: 2-cyclohexyl-4-[[4-(dimethylamino)-5-methyl-pyrimidin-2-yl]amino]-3-methyl-benzamide hydrochloride Openeye Name: 2-cyclohexyl-4-[[4-(dimethylamino)-5-methyl-pyrimidin-2-yl]amino]-3-methyl-benzamide hydrochloride CAS Name: 2-cyclohexyl-4-[[4-(dimethylamino)-5-methyl-2-pyrimidinyl]amino]-3-methylbenzamide hydrochloride IUPAC Name: 2-cyclohexyl-4-[[4-(dimethylamino)-5-methylpyrimidin-2-yl]amino]-3-methylbenzamide hydrochloride Traditional Name: 2-cyclohexyl-4-[[4-(dimethylamino)-5-methyl-pyrimidin-2-yl]amino]-3-methyl-benzamide hydrochloride Formula: C21H30ClN5O MolecularWeight: 403.9488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N5O.ClH/c1-13-12-23-21(25-20(13)26(3)4)24-17-11-10-16(19(22)27)18(14(17)2)15-8-6-5-7-9-15;/h10-12,15H,5-9H2,1-4H3,(H2,22,27)(H,23,24,25);1H