3,3-dimethyl-1-[2-methyl-4-[3-(5-methylsulfonylthiophen-2-yl)pentan-3-yl]phenoxy]butan-2-one

Systemtic Name: 3,3-dimethyl-1-[2-methyl-4-[3-(5-methylsulfonylthiophen-2-yl)pentan-3-yl]phenoxy]butan-2-one Openeye Name: 1-[4-[1-ethyl-1-(5-methylsulfonyl-2-thienyl)propyl]-2-methyl-phenoxy]-3,3-dimethyl-butan-2-one CAS Name: 3,3-dimethyl-1-[2-methyl-4-[3-(5-methylsulfonyl-2-thiophenyl)pentan-3-yl]phenoxy]-2-butanone IUPAC Name: 3,3-dimethyl-1-[2-methyl-4-[3-(5-methylsulfonylthiophen-2-yl)pentan-3-yl]phenoxy]butan-2-one Traditional Name: 1-[4-[1-ethyl-1-(5-mesyl-2-thienyl)propyl]-2-methyl-phenoxy]-3,3-dimethyl-butan-2-one Formula: C23H32O4S2 MolecularWeight: 436.62778

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=CC(=C(C=C1)OCC(=O)C(C)(C)C)C)C2=CC=C(S2)S(=O)(=O)C

Isomeric SMILES

CCC(CC)(C1=CC(=C(C=C1)OCC(=O)C(C)(C)C)C)C2=CC=C(S2)S(=O)(=O)C

InChI

InChI=1S/C23H32O4S2/c1-8-23(9-2,20-12-13-21(28-20)29(7,25)26)17-10-11-18(16(3)14-17)27-15-19(24)22(4,5)6/h10-14H,8-9,15H2,1-7H3