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

Systemtic Name: N-[3-[2-[[4-[bis(phenylmethyl)carbamoyl]phenyl]amino]pyrimidin-4-yl]-2-methyl-phenyl]-4-tert-butyl-benzamide Openeye Name: 4-tert-butyl-N-[3-[2-[4-(dibenzylcarbamoyl)anilino]pyrimidin-4-yl]-2-methyl-phenyl]benzamide CAS Name: N-[3-[2-[4-[[bis(phenylmethyl)amino]-oxomethyl]anilino]-4-pyrimidinyl]-2-methylphenyl]-4-tert-butylbenzamide IUPAC Name: 4-tert-butyl-N-[3-[2-[4-(dibenzylcarbamoyl)anilino]pyrimidin-4-yl]-2-methylphenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[2-[4-(dibenzylcarbamoyl)anilino]pyrimidin-4-yl]-2-methyl-phenyl]benzamide Formula: C43H41N5O2 MolecularWeight: 659.81794

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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(CC5=CC=CC=C5)CC6=CC=CC=C6

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(CC5=CC=CC=C5)CC6=CC=CC=C6

InChI

InChI=1S/C43H41N5O2/c1-30-37(16-11-17-38(30)46-40(49)33-18-22-35(23-19-33)43(2,3)4)39-26-27-44-42(47-39)45-36-24-20-34(21-25-36)41(50)48(28-31-12-7-5-8-13-31)29-32-14-9-6-10-15-32/h5-27H,28-29H2,1-4H3,(H,46,49)(H,44,45,47)