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

Systemtic Name: 4-tert-butyl-N-[3-[2-[[4-[cyclohexyl(methyl)carbamoyl]phenyl]amino]pyrimidin-4-yl]-2-methyl-phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[2-[4-[cyclohexyl(methyl)carbamoyl]anilino]pyrimidin-4-yl]-2-methyl-phenyl]benzamide CAS Name: 4-tert-butyl-N-[3-[2-[4-[[cyclohexyl(methyl)amino]-oxomethyl]anilino]-4-pyrimidinyl]-2-methylphenyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[2-[4-[cyclohexyl(methyl)carbamoyl]anilino]pyrimidin-4-yl]-2-methylphenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[2-[4-[cyclohexyl(methyl)carbamoyl]anilino]pyrimidin-4-yl]-2-methyl-phenyl]benzamide Formula: C36H41N5O2 MolecularWeight: 575.74304

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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)C5CCCCC5

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)C5CCCCC5

InChI

InChI=1S/C36H41N5O2/c1-24-30(12-9-13-31(24)39-33(42)25-14-18-27(19-15-25)36(2,3)4)32-22-23-37-35(40-32)38-28-20-16-26(17-21-28)34(43)41(5)29-10-7-6-8-11-29/h9,12-23,29H,6-8,10-11H2,1-5H3,(H,39,42)(H,37,38,40)