4-tert-butyl-N-[2-methyl-3-[2-[[4-[methyl(phenethyl)carbamoyl]phenyl]amino]pyrimidin-4-yl]phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[2-methyl-3-[2-[[4-[methyl(phenethyl)carbamoyl]phenyl]amino]pyrimidin-4-yl]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[2-methyl-3-[2-[4-[methyl(phenethyl)carbamoyl]anilino]pyrimidin-4-yl]phenyl]benzamide CAS Name: 4-tert-butyl-N-[2-methyl-3-[2-[4-[[methyl(phenethyl)amino]-oxomethyl]anilino]-4-pyrimidinyl]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[2-methyl-3-[2-[4-[methyl(phenethyl)carbamoyl]anilino]pyrimidin-4-yl]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[2-methyl-3-[2-[4-[methyl(phenethyl)carbamoyl]anilino]pyrimidin-4-yl]phenyl]benzamide Formula: C38H39N5O2 MolecularWeight: 597.74856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C2=CC=C(C=C2)C(C)(C)C)C3=NC(=NC=C3)NC4=CC=C(C=C4)C(=O)N(C)CCC5=CC=CC=C5

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)C2=CC=C(C=C2)C(C)(C)C)C3=NC(=NC=C3)NC4=CC=C(C=C4)C(=O)N(C)CCC5=CC=CC=C5

InChI

InChI=1S/C38H39N5O2/c1-26-32(12-9-13-33(26)41-35(44)28-14-18-30(19-15-28)38(2,3)4)34-22-24-39-37(42-34)40-31-20-16-29(17-21-31)36(45)43(5)25-23-27-10-7-6-8-11-27/h6-22,24H,23,25H2,1-5H3,(H,41,44)(H,39,40,42)