N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-1-(phenylmethyl)indole-3-carboxamide

Systemtic Name: N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-1-(phenylmethyl)indole-3-carboxamide Openeye Name: 1-benzyl-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]indole-3-carboxamide CAS Name: N-[4-[[4-(dimethylamino)-2-pyrimidinyl]amino]cyclohexyl]-1-(phenylmethyl)-3-indolecarboxamide IUPAC Name: 1-benzyl-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]indole-3-carboxamide Traditional Name: 1-benzyl-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]indole-3-carboxamide Formula: C28H32N6O MolecularWeight: 468.59328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC=C1)NC2CCC(CC2)NC(=O)C3=CN(C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

CN(C)C1=NC(=NC=C1)NC2CCC(CC2)NC(=O)C3=CN(C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C28H32N6O/c1-33(2)26-16-17-29-28(32-26)31-22-14-12-21(13-15-22)30-27(35)24-19-34(18-20-8-4-3-5-9-20)25-11-7-6-10-23(24)25/h3-11,16-17,19,21-22H,12-15,18H2,1-2H3,(H,30,35)(H,29,31,32)