ethane; 6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-7-oxidanyl-2,3-dihydrochromen-4-one

Systemtic Name: ethane; 6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-7-oxidanyl-2,3-dihydrochromen-4-one Openeye Name: ethane; 6-ethyl-7-hydroxy-3-(4-methylthiazol-2-yl)chroman-4-one CAS Name: ethane; 6-ethyl-7-hydroxy-3-(4-methyl-2-thiazolyl)-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: ethane; 6-ethyl-7-hydroxy-3-(4-methyl-1,3-thiazol-2-yl)-2,3-dihydrochromen-4-one Traditional Name: ethane; 6-ethyl-7-hydroxy-3-(4-methylthiazol-2-yl)chroman-4-one Formula: C17H21NO3S MolecularWeight: 319.41854

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Descriptors Computed from Structure

Canonical SMILES:

CC.CCC1=C(C=C2C(=C1)C(=O)C(CO2)C3=NC(=CS3)C)O

Isomeric SMILES

CC.CCC1=C(C=C2C(=C1)C(=O)C(CO2)C3=NC(=CS3)C)O

InChI

InChI=1S/C15H15NO3S.C2H6/c1-3-9-4-10-13(5-12(9)17)19-6-11(14(10)18)15-16-8(2)7-20-15;1-2/h4-5,7,11,17H,3,6H2,1-2H3;1-2H3