1-(2-tert-butyl-4,4-dimethyl-2,3-dihydrothiochromen-6-yl)pentan-1-one

Systemtic Name: 1-(2-tert-butyl-4,4-dimethyl-2,3-dihydrothiochromen-6-yl)pentan-1-one Openeye Name: 1-(2-tert-butyl-4,4-dimethyl-thiochroman-6-yl)pentan-1-one CAS Name: 1-(2-tert-butyl-4,4-dimethyl-2,3-dihydro-1-benzothiopyran-6-yl)-1-pentanone IUPAC Name: 1-(2-tert-butyl-4,4-dimethyl-2,3-dihydrothiochromen-6-yl)pentan-1-one Traditional Name: 1-(2-tert-butyl-4,4-dimethyl-thiochroman-6-yl)pentan-1-one Formula: C20H30OS MolecularWeight: 318.5166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=CC2=C(C=C1)SC(CC2(C)C)C(C)(C)C

Isomeric SMILES

CCCCC(=O)C1=CC2=C(C=C1)SC(CC2(C)C)C(C)(C)C

InChI

InChI=1S/C20H30OS/c1-7-8-9-16(21)14-10-11-17-15(12-14)20(5,6)13-18(22-17)19(2,3)4/h10-12,18H,7-9,13H2,1-6H3