N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-4-methoxy-3-phenylmethoxy-benzamide

Systemtic Name: N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-4-methoxy-3-phenylmethoxy-benzamide Openeye Name: 3-benzyloxy-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-4-methoxy-benzamide CAS Name: N-[4-[[4-(dimethylamino)-2-pyrimidinyl]amino]cyclohexyl]-4-methoxy-3-phenylmethoxybenzamide IUPAC Name: N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-4-methoxy-3-phenylmethoxybenzamide Traditional Name: 3-benzoxy-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-4-methoxy-benzamide Formula: C27H33N5O3 MolecularWeight: 475.58262

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC=C1)NC2CCC(CC2)NC(=O)C3=CC(=C(C=C3)OC)OCC4=CC=CC=C4

Isomeric SMILES

CN(C)C1=NC(=NC=C1)NC2CCC(CC2)NC(=O)C3=CC(=C(C=C3)OC)OCC4=CC=CC=C4

InChI

InChI=1S/C27H33N5O3/c1-32(2)25-15-16-28-27(31-25)30-22-12-10-21(11-13-22)29-26(33)20-9-14-23(34-3)24(17-20)35-18-19-7-5-4-6-8-19/h4-9,14-17,21-22H,10-13,18H2,1-3H3,(H,29,33)(H,28,30,31)