4-bromanyl-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-3-methyl-benzamide

Systemtic Name: 4-bromanyl-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-3-methyl-benzamide Openeye Name: 4-bromo-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-3-methyl-benzamide CAS Name: 4-bromo-N-[4-[[4-(dimethylamino)-2-pyrimidinyl]amino]cyclohexyl]-3-methylbenzamide IUPAC Name: 4-bromo-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-3-methylbenzamide Traditional Name: 4-bromo-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-3-methyl-benzamide Formula: C20H26BrN5O MolecularWeight: 432.35734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2CCC(CC2)NC3=NC=CC(=N3)N(C)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2CCC(CC2)NC3=NC=CC(=N3)N(C)C)Br

InChI

InChI=1S/C20H26BrN5O/c1-13-12-14(4-9-17(13)21)19(27)23-15-5-7-16(8-6-15)24-20-22-11-10-18(25-20)26(2)3/h4,9-12,15-16H,5-8H2,1-3H3,(H,23,27)(H,22,24,25)