N-[5-tert-butyl-2-methoxy-3-(methylsulfonylamino)phenyl]-4-methyl-3-[2-(piperazin-1-ylmethyl)pyrimidin-4-yl]oxy-benzamide

Systemtic Name: N-[5-tert-butyl-2-methoxy-3-(methylsulfonylamino)phenyl]-4-methyl-3-[2-(piperazin-1-ylmethyl)pyrimidin-4-yl]oxy-benzamide Openeye Name: N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxy-phenyl]-4-methyl-3-[2-(piperazin-1-ylmethyl)pyrimidin-4-yl]oxy-benzamide CAS Name: N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxyphenyl]-4-methyl-3-[[2-(1-piperazinylmethyl)-4-pyrimidinyl]oxy]benzamide IUPAC Name: N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxyphenyl]-4-methyl-3-[2-(piperazin-1-ylmethyl)pyrimidin-4-yl]oxybenzamide Traditional Name: N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxy-phenyl]-4-methyl-3-[2-(piperazinomethyl)pyrimidin-4-yl]oxy-benzamide Formula: C29H38N6O5S MolecularWeight: 582.71422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=C(C(=CC(=C2)C(C)(C)C)NS(=O)(=O)C)OC)OC3=NC(=NC=C3)CN4CCNCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C(C(=CC(=C2)C(C)(C)C)NS(=O)(=O)C)OC)OC3=NC(=NC=C3)CN4CCNCC4

InChI

InChI=1S/C29H38N6O5S/c1-19-7-8-20(15-24(19)40-26-9-10-31-25(33-26)18-35-13-11-30-12-14-35)28(36)32-22-16-21(29(2,3)4)17-23(27(22)39-5)34-41(6,37)38/h7-10,15-17,30,34H,11-14,18H2,1-6H3,(H,32,36)