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

Systemtic Name: N-[5-tert-butyl-2-methoxy-3-(methylsulfonylamino)phenyl]-1-methyl-7-[2-[(phenylmethyl)amino]pyrimidin-4-yl]oxy-indole-2-carboxamide Openeye Name: 7-[2-(benzylamino)pyrimidin-4-yl]oxy-N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxy-phenyl]-1-methyl-indole-2-carboxamide CAS Name: N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxyphenyl]-1-methyl-7-[[2-[(phenylmethyl)amino]-4-pyrimidinyl]oxy]-2-indolecarboxamide IUPAC Name: 7-[2-(benzylamino)pyrimidin-4-yl]oxy-N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxyphenyl]-1-methylindole-2-carboxamide Traditional Name: 7-[2-(benzylamino)pyrimidin-4-yl]oxy-N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxy-phenyl]-1-methyl-indole-2-carboxamide Formula: C33H36N6O5S MolecularWeight: 628.74114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)NS(=O)(=O)C)OC)NC(=O)C2=CC3=C(N2C)C(=CC=C3)OC4=NC(=NC=C4)NCC5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)NS(=O)(=O)C)OC)NC(=O)C2=CC3=C(N2C)C(=CC=C3)OC4=NC(=NC=C4)NCC5=CC=CC=C5

InChI

InChI=1S/C33H36N6O5S/c1-33(2,3)23-18-24(30(43-5)25(19-23)38-45(6,41)42)36-31(40)26-17-22-13-10-14-27(29(22)39(26)4)44-28-15-16-34-32(37-28)35-20-21-11-8-7-9-12-21/h7-19,38H,20H2,1-6H3,(H,36,40)(H,34,35,37)