N-[5-tert-butyl-3-(dimethylaminomethyl)-2-methoxy-phenyl]-1-methyl-7-[2-(methylamino)pyrimidin-4-yl]oxy-indole-2-carboxamide

Systemtic Name: N-[5-tert-butyl-3-(dimethylaminomethyl)-2-methoxy-phenyl]-1-methyl-7-[2-(methylamino)pyrimidin-4-yl]oxy-indole-2-carboxamide Openeye Name: N-[5-tert-butyl-3-(dimethylaminomethyl)-2-methoxy-phenyl]-1-methyl-7-[2-(methylamino)pyrimidin-4-yl]oxy-indole-2-carboxamide CAS Name: N-[5-tert-butyl-3-(dimethylaminomethyl)-2-methoxyphenyl]-1-methyl-7-[[2-(methylamino)-4-pyrimidinyl]oxy]-2-indolecarboxamide IUPAC Name: N-[5-tert-butyl-3-(dimethylaminomethyl)-2-methoxyphenyl]-1-methyl-7-[2-(methylamino)pyrimidin-4-yl]oxyindole-2-carboxamide Traditional Name: N-[5-tert-butyl-3-(dimethylaminomethyl)-2-methoxy-phenyl]-1-methyl-7-[2-(methylamino)pyrimidin-4-yl]oxy-indole-2-carboxamide Formula: C29H36N6O3 MolecularWeight: 516.63454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)NC(=O)C2=CC3=C(N2C)C(=CC=C3)OC4=NC(=NC=C4)NC)OC)CN(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)NC(=O)C2=CC3=C(N2C)C(=CC=C3)OC4=NC(=NC=C4)NC)OC)CN(C)C

InChI

InChI=1S/C29H36N6O3/c1-29(2,3)20-14-19(17-34(5)6)26(37-8)21(16-20)32-27(36)22-15-18-10-9-11-23(25(18)35(22)7)38-24-12-13-31-28(30-4)33-24/h9-16H,17H2,1-8H3,(H,32,36)(H,30,31,33)