N-[3-(tert-butylamino)-3-oxidanylidene-1-thiophen-2-yl-propyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-[3-(tert-butylamino)-3-oxidanylidene-1-thiophen-2-yl-propyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-[3-(tert-butylamino)-3-oxo-1-(2-thienyl)propyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-[3-(tert-butylamino)-3-oxo-1-thiophen-2-ylpropyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-[3-(tert-butylamino)-3-oxo-1-thiophen-2-ylpropyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-[3-(tert-butylamino)-3-keto-1-(2-thienyl)propyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CC(C1=CC=CS1)NC(=O)C2COC3=CC=CC=C3O2

Isomeric SMILES

CC(C)(C)NC(=O)CC(C1=CC=CS1)NC(=O)C2COC3=CC=CC=C3O2

InChI

InChI=1S/C20H24N2O4S/c1-20(2,3)22-18(23)11-13(17-9-6-10-27-17)21-19(24)16-12-25-14-7-4-5-8-15(14)26-16/h4-10,13,16H,11-12H2,1-3H3,(H,21,24)(H,22,23)