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

Systemtic Name: 5-[[4-tert-butyl-6-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]pyrimidin-2-yl]sulfanylmethyl]-N-propan-2-yl-furan-2-carboxamide Openeye Name: 5-[[4-tert-butyl-6-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]pyrimidin-2-yl]sulfanylmethyl]-N-isopropyl-furan-2-carboxamide CAS Name: 5-[[[4-tert-butyl-6-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-pyrimidinyl]thio]methyl]-N-propan-2-yl-2-furancarboxamide IUPAC Name: 5-[[4-tert-butyl-6-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]pyrimidin-2-yl]sulfanylmethyl]-N-propan-2-ylfuran-2-carboxamide Traditional Name: 5-[[[4-tert-butyl-6-[homoveratryl(methyl)amino]pyrimidin-2-yl]thio]methyl]-N-isopropyl-2-furamide Formula: C28H38N4O4S MolecularWeight: 526.69072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC=C(O1)CSC2=NC(=CC(=N2)N(C)CCC3=CC(=C(C=C3)OC)OC)C(C)(C)C

Isomeric SMILES

CC(C)NC(=O)C1=CC=C(O1)CSC2=NC(=CC(=N2)N(C)CCC3=CC(=C(C=C3)OC)OC)C(C)(C)C

InChI

InChI=1S/C28H38N4O4S/c1-18(2)29-26(33)22-12-10-20(36-22)17-37-27-30-24(28(3,4)5)16-25(31-27)32(6)14-13-19-9-11-21(34-7)23(15-19)35-8/h9-12,15-16,18H,13-14,17H2,1-8H3,(H,29,33)