N-[2-(tert-butylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-N-(furan-2-ylmethyl)-5-oxidanylidene-thiolane-3-carboxamide

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-N-(furan-2-ylmethyl)-5-oxidanylidene-thiolane-3-carboxamide Openeye Name: N-[2-(tert-butylamino)-2-oxo-1-(4-pyridyl)ethyl]-N-(2-furylmethyl)-5-oxo-tetrahydrothiophene-3-carboxamide CAS Name: N-[2-(tert-butylamino)-2-oxo-1-pyridin-4-ylethyl]-N-(2-furanylmethyl)-5-oxo-3-thiolanecarboxamide IUPAC Name: N-[2-(tert-butylamino)-2-oxo-1-pyridin-4-ylethyl]-N-(furan-2-ylmethyl)-5-oxothiolane-3-carboxamide Traditional Name: N-[2-(tert-butylamino)-2-keto-1-(4-pyridyl)ethyl]-N-(2-furfuryl)-5-keto-tetrahydrothiophene-3-carboxamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C(C1=CC=NC=C1)N(CC2=CC=CO2)C(=O)C3CC(=O)SC3

Isomeric SMILES

CC(C)(C)NC(=O)C(C1=CC=NC=C1)N(CC2=CC=CO2)C(=O)C3CC(=O)SC3

InChI

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