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

Systemtic Name: 2,2-dimethyl-7-pentyl-4-(prop-2-enylamino)-3H-thiochromen-5-one Openeye Name: 4-(allylamino)-2,2-dimethyl-7-pentyl-3H-thiochromen-5-one CAS Name: 2,2-dimethyl-7-pentyl-4-(prop-2-enylamino)-3H-1-benzothiopyran-5-one IUPAC Name: 2,2-dimethyl-7-pentyl-4-(prop-2-enylamino)-3H-thiochromen-5-one Traditional Name: 4-(allylamino)-7-amyl-2,2-dimethyl-3H-thiochromen-5-one Formula: C19H27NOS MolecularWeight: 317.48878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27NOS/c1-5-7-8-9-14-11-16(21)18-15(20-10-6-2)13-19(3,4)22-17(18)12-14/h6,11-12,20H,2,5,7-10,13H2,1,3-4H3