2-methyl-4-(2-oxidanylpropylamino)-7-pentyl-2,3-dihydrothiochromen-5-one

Systemtic Name: 2-methyl-4-(2-oxidanylpropylamino)-7-pentyl-2,3-dihydrothiochromen-5-one Openeye Name: 4-(2-hydroxypropylamino)-2-methyl-7-pentyl-2,3-dihydrothiochromen-5-one CAS Name: 4-(2-hydroxypropylamino)-2-methyl-7-pentyl-2,3-dihydro-1-benzothiopyran-5-one IUPAC Name: 4-(2-hydroxypropylamino)-2-methyl-7-pentyl-2,3-dihydrothiochromen-5-one Traditional Name: 7-amyl-4-(2-hydroxypropylamino)-2-methyl-2,3-dihydrothiochromen-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)NCC(C)O

Isomeric SMILES

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

InChI

InChI=1S/C18H27NO2S/c1-4-5-6-7-14-9-16(21)18-15(19-11-12(2)20)8-13(3)22-17(18)10-14/h9-10,12-13,19-20H,4-8,11H2,1-3H3