2-[[3,3-dimethylbutanoyl(furan-2-ylmethyl)amino]methyl]-N-(furan-2-ylmethyl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[3,3-dimethylbutanoyl(furan-2-ylmethyl)amino]methyl]-N-(furan-2-ylmethyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[[3,3-dimethylbutanoyl(2-furylmethyl)amino]methyl]-N-(2-furylmethyl)thiazole-4-carboxamide CAS Name: 2-[[(3,3-dimethyl-1-oxobutyl)-(2-furanylmethyl)amino]methyl]-N-(2-furanylmethyl)-4-thiazolecarboxamide IUPAC Name: 2-[[3,3-dimethylbutanoyl(furan-2-ylmethyl)amino]methyl]-N-(furan-2-ylmethyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[[3,3-dimethylbutanoyl(2-furfuryl)amino]methyl]-N-(2-furfuryl)thiazole-4-carboxamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N(CC1=CC=CO1)CC2=NC(=CS2)C(=O)NCC3=CC=CO3

Isomeric SMILES

CC(C)(C)CC(=O)N(CC1=CC=CO1)CC2=NC(=CS2)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C21H25N3O4S/c1-21(2,3)10-19(25)24(12-16-7-5-9-28-16)13-18-23-17(14-29-18)20(26)22-11-15-6-4-8-27-15/h4-9,14H,10-13H2,1-3H3,(H,22,26)