4-(2-hydroxyethylamino)-2,2-dimethyl-7-pentyl-3H-thiochromen-5-one

Systemtic Name: 4-(2-hydroxyethylamino)-2,2-dimethyl-7-pentyl-3H-thiochromen-5-one Openeye Name: 4-(2-hydroxyethylamino)-2,2-dimethyl-7-pentyl-3H-thiochromen-5-one CAS Name: 4-(2-hydroxyethylamino)-2,2-dimethyl-7-pentyl-3H-1-benzothiopyran-5-one IUPAC Name: 4-(2-hydroxyethylamino)-2,2-dimethyl-7-pentyl-3H-thiochromen-5-one Traditional Name: 7-amyl-4-(2-hydroxyethylamino)-2,2-dimethyl-3H-thiochromen-5-one Formula: C18H27NO2S MolecularWeight: 321.47748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=O)C2=C(CC(SC2=C1)(C)C)NCCO

Isomeric SMILES

CCCCCC1=CC(=O)C2=C(CC(SC2=C1)(C)C)NCCO

InChI

InChI=1S/C18H27NO2S/c1-4-5-6-7-13-10-15(21)17-14(19-8-9-20)12-18(2,3)22-16(17)11-13/h10-11,19-20H,4-9,12H2,1-3H3