2-[[2-[(3-chlorophenyl)methylamino]-6-imidazol-1-yl-pyrimidin-4-yl]amino]-3-cyclohexyl-N-(pyridin-4-ylmethyl)propanamide

Systemtic Name: 2-[[2-[(3-chlorophenyl)methylamino]-6-imidazol-1-yl-pyrimidin-4-yl]amino]-3-cyclohexyl-N-(pyridin-4-ylmethyl)propanamide Openeye Name: 2-[[2-[(3-chlorophenyl)methylamino]-6-imidazol-1-yl-pyrimidin-4-yl]amino]-3-cyclohexyl-N-(4-pyridylmethyl)propanamide CAS Name: 2-[[2-[(3-chlorophenyl)methylamino]-6-(1-imidazolyl)-4-pyrimidinyl]amino]-3-cyclohexyl-N-(pyridin-4-ylmethyl)propanamide IUPAC Name: 2-[[2-[(3-chlorophenyl)methylamino]-6-imidazol-1-ylpyrimidin-4-yl]amino]-3-cyclohexyl-N-(pyridin-4-ylmethyl)propanamide Traditional Name: 2-[[2-[(3-chlorobenzyl)amino]-6-imidazol-1-yl-pyrimidin-4-yl]amino]-3-cyclohexyl-N-(4-pyridylmethyl)propionamide Formula: C29H33ClN8O MolecularWeight: 545.07832

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)NCC2=CC=NC=C2)NC3=NC(=NC(=C3)N4C=CN=C4)NCC5=CC(=CC=C5)Cl

Isomeric SMILES

C1CCC(CC1)CC(C(=O)NCC2=CC=NC=C2)NC3=NC(=NC(=C3)N4C=CN=C4)NCC5=CC(=CC=C5)Cl

InChI

InChI=1S/C29H33ClN8O/c30-24-8-4-7-23(15-24)19-34-29-36-26(17-27(37-29)38-14-13-32-20-38)35-25(16-21-5-2-1-3-6-21)28(39)33-18-22-9-11-31-12-10-22/h4,7-15,17,20-21,25H,1-3,5-6,16,18-19H2,(H,33,39)(H2,34,35,36,37)