2-methyl-4-(2-oxidanylpropylamino)-7-pentyl-2,3-dihydrochromene-5-thione

Systemtic Name: 2-methyl-4-(2-oxidanylpropylamino)-7-pentyl-2,3-dihydrochromene-5-thione Openeye Name: 4-(2-hydroxypropylamino)-2-methyl-7-pentyl-2,3-dihydrochromene-5-thione CAS Name: 4-(2-hydroxypropylamino)-2-methyl-7-pentyl-2,3-dihydro-1-benzopyran-5-thione IUPAC Name: 4-(2-hydroxypropylamino)-2-methyl-7-pentyl-2,3-dihydrochromene-5-thione Traditional Name: 7-amyl-4-(2-hydroxypropylamino)-2-methyl-2,3-dihydrochromene-5-thione Formula: C18H27NO2S MolecularWeight: 321.47748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=S)C2=C(CC(OC2=C1)C)NCC(C)O

Isomeric SMILES

CCCCCC1=CC(=S)C2=C(CC(OC2=C1)C)NCC(C)O

InChI

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