3,6,6-trimethyl-4-oxidanylidene-N-(thiophen-2-ylmethyl)-5,7-dihydro-1-benzofuran-2-carboxamide

Systemtic Name: 3,6,6-trimethyl-4-oxidanylidene-N-(thiophen-2-ylmethyl)-5,7-dihydro-1-benzofuran-2-carboxamide Openeye Name: 3,6,6-trimethyl-4-oxo-N-(2-thienylmethyl)-5,7-dihydrobenzofuran-2-carboxamide CAS Name: 3,6,6-trimethyl-4-oxo-N-(thiophen-2-ylmethyl)-5,7-dihydrobenzofuran-2-carboxamide IUPAC Name: 3,6,6-trimethyl-4-oxo-N-(thiophen-2-ylmethyl)-5,7-dihydro-1-benzofuran-2-carboxamide Traditional Name: 4-keto-3,6,6-trimethyl-N-(2-thenyl)-5,7-dihydrobenzofuran-2-carboxamide Formula: C17H19NO3S MolecularWeight: 317.40266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)NCC3=CC=CS3

Isomeric SMILES

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)NCC3=CC=CS3

InChI

InChI=1S/C17H19NO3S/c1-10-14-12(19)7-17(2,3)8-13(14)21-15(10)16(20)18-9-11-5-4-6-22-11/h4-6H,7-9H2,1-3H3,(H,18,20)