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

Systemtic Name: 3,3-dimethyl-1-[2-methyl-4-[3-[4-methyl-5-(methylsulfonylmethyl)thiophen-2-yl]pentan-3-yl]phenoxy]butan-2-one Openeye Name: 1-[4-[1-ethyl-1-[4-methyl-5-(methylsulfonylmethyl)-2-thienyl]propyl]-2-methyl-phenoxy]-3,3-dimethyl-butan-2-one CAS Name: 3,3-dimethyl-1-[2-methyl-4-[3-[4-methyl-5-(methylsulfonylmethyl)-2-thiophenyl]pentan-3-yl]phenoxy]-2-butanone IUPAC Name: 3,3-dimethyl-1-[2-methyl-4-[3-[4-methyl-5-(methylsulfonylmethyl)thiophen-2-yl]pentan-3-yl]phenoxy]butan-2-one Traditional Name: 1-[4-[1-ethyl-1-[5-(mesylmethyl)-4-methyl-2-thienyl]propyl]-2-methyl-phenoxy]-3,3-dimethyl-butan-2-one Formula: C25H36O4S2 MolecularWeight: 464.68094

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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)CS(=O)(=O)C)C

Isomeric SMILES

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

InChI

InChI=1S/C25H36O4S2/c1-9-25(10-2,23-14-18(4)21(30-23)16-31(8,27)28)19-11-12-20(17(3)13-19)29-15-22(26)24(5,6)7/h11-14H,9-10,15-16H2,1-8H3