3-methyl-1-[5-[2-(4-prop-2-ynylphenyl)ethyl]thiophen-2-yl]butan-1-one

Systemtic Name: 3-methyl-1-[5-[2-(4-prop-2-ynylphenyl)ethyl]thiophen-2-yl]butan-1-one Openeye Name: 3-methyl-1-[5-[2-(4-prop-2-ynylphenyl)ethyl]-2-thienyl]butan-1-one CAS Name: 3-methyl-1-[5-[2-(4-prop-2-ynylphenyl)ethyl]-2-thiophenyl]-1-butanone IUPAC Name: 3-methyl-1-[5-[2-(4-prop-2-ynylphenyl)ethyl]thiophen-2-yl]butan-1-one Traditional Name: 3-methyl-1-[5-[2-(4-propargylphenyl)ethyl]-2-thienyl]butan-1-one Formula: C20H22OS MolecularWeight: 310.45308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C1=CC=C(S1)CCC2=CC=C(C=C2)CC#C

Isomeric SMILES

CC(C)CC(=O)C1=CC=C(S1)CCC2=CC=C(C=C2)CC#C

InChI

InChI=1S/C20H22OS/c1-4-5-16-6-8-17(9-7-16)10-11-18-12-13-20(22-18)19(21)14-15(2)3/h1,6-9,12-13,15H,5,10-11,14H2,2-3H3