1-(but-3-yn-2-ylsulfanylmethyl)-4-methoxy-benzene

Systemtic Name: 1-(but-3-yn-2-ylsulfanylmethyl)-4-methoxy-benzene Openeye Name: 1-methoxy-4-(1-methylprop-2-ynylsulfanylmethyl)benzene CAS Name: 1-[(but-3-yn-2-ylthio)methyl]-4-methoxybenzene IUPAC Name: 1-(but-3-yn-2-ylsulfanylmethyl)-4-methoxybenzene Traditional Name: 1-methoxy-4-[(1-methylprop-2-ynylthio)methyl]benzene Formula: C12H14OS MolecularWeight: 206.30396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C#C)SCC1=CC=C(C=C1)OC

Isomeric SMILES

CC(C#C)SCC1=CC=C(C=C1)OC

InChI

InChI=1S/C12H14OS/c1-4-10(2)14-9-11-5-7-12(13-3)8-6-11/h1,5-8,10H,9H2,2-3H3