2-[(4-chlorophenyl)methyl-(2,6-diphenylpyrimidin-4-yl)amino]-N-cyclohexyl-butanamide

Systemtic Name: 2-[(4-chlorophenyl)methyl-(2,6-diphenylpyrimidin-4-yl)amino]-N-cyclohexyl-butanamide Openeye Name: 2-[(4-chlorophenyl)methyl-(2,6-diphenylpyrimidin-4-yl)amino]-N-cyclohexyl-butanamide CAS Name: 2-[(4-chlorophenyl)methyl-(2,6-diphenyl-4-pyrimidinyl)amino]-N-cyclohexylbutanamide IUPAC Name: 2-[(4-chlorophenyl)methyl-(2,6-diphenylpyrimidin-4-yl)amino]-N-cyclohexylbutanamide Traditional Name: 2-[(4-chlorobenzyl)-(2,6-diphenylpyrimidin-4-yl)amino]-N-cyclohexyl-butyramide Formula: C33H35ClN4O MolecularWeight: 539.1102

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1CCCCC1)N(CC2=CC=C(C=C2)Cl)C3=NC(=NC(=C3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCC(C(=O)NC1CCCCC1)N(CC2=CC=C(C=C2)Cl)C3=NC(=NC(=C3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H35ClN4O/c1-2-30(33(39)35-28-16-10-5-11-17-28)38(23-24-18-20-27(34)21-19-24)31-22-29(25-12-6-3-7-13-25)36-32(37-31)26-14-8-4-9-15-26/h3-4,6-9,12-15,18-22,28,30H,2,5,10-11,16-17,23H2,1H3,(H,35,39)