N-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)ethanethioamide

Systemtic Name: N-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)ethanethioamide Openeye Name: N-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)thioacetamide CAS Name: N-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)ethanethioamide IUPAC Name: N-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)ethanethioamide Traditional Name: N-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)thioacetamide Formula: C14H16N2O2S MolecularWeight: 276.35404

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)NC1C(C(OC2=C1C=C(C=C2)C#N)(C)C)O

Isomeric SMILES

CC(=S)NC1C(C(OC2=C1C=C(C=C2)C#N)(C)C)O

InChI

InChI=1S/C14H16N2O2S/c1-8(19)16-12-10-6-9(7-15)4-5-11(10)18-14(2,3)13(12)17/h4-6,12-13,17H,1-3H3,(H,16,19)