5-[[4-tert-butyl-6-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]pyrimidin-2-yl]sulfanylmethyl]-N-cyclopropyl-furan-2-carboxamide

Systemtic Name: 5-[[4-tert-butyl-6-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]pyrimidin-2-yl]sulfanylmethyl]-N-cyclopropyl-furan-2-carboxamide Openeye Name: 5-[[4-tert-butyl-6-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]pyrimidin-2-yl]sulfanylmethyl]-N-cyclopropyl-furan-2-carboxamide CAS Name: 5-[[[4-tert-butyl-6-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-pyrimidinyl]thio]methyl]-N-cyclopropyl-2-furancarboxamide IUPAC Name: 5-[[4-tert-butyl-6-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]pyrimidin-2-yl]sulfanylmethyl]-N-cyclopropylfuran-2-carboxamide Traditional Name: 5-[[[4-tert-butyl-6-[homoveratryl(methyl)amino]pyrimidin-2-yl]thio]methyl]-N-cyclopropyl-2-furamide Formula: C28H36N4O4S MolecularWeight: 524.67484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NC3CC3)N(C)CCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC(C)(C)C1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NC3CC3)N(C)CCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C28H36N4O4S/c1-28(2,3)24-16-25(32(4)14-13-18-7-11-21(34-5)23(15-18)35-6)31-27(30-24)37-17-20-10-12-22(36-20)26(33)29-19-8-9-19/h7,10-12,15-16,19H,8-9,13-14,17H2,1-6H3,(H,29,33)