2-[4-[(4-ethynylphenyl)methyl]-1-(thiophen-3-ylmethyl)piperazin-2-yl]ethanol

Systemtic Name: 2-[4-[(4-ethynylphenyl)methyl]-1-(thiophen-3-ylmethyl)piperazin-2-yl]ethanol Openeye Name: 2-[4-[(4-ethynylphenyl)methyl]-1-(3-thienylmethyl)piperazin-2-yl]ethanol CAS Name: 2-[4-[(4-ethynylphenyl)methyl]-1-(3-thiophenylmethyl)-2-piperazinyl]ethanol IUPAC Name: 2-[4-[(4-ethynylphenyl)methyl]-1-(thiophen-3-ylmethyl)piperazin-2-yl]ethanol Traditional Name: 2-[4-(4-ethynylbenzyl)-1-(3-thenyl)piperazin-2-yl]ethanol Formula: C20H24N2OS MolecularWeight: 340.48236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC=C(C=C1)CN2CCN(C(C2)CCO)CC3=CSC=C3

Isomeric SMILES

C#CC1=CC=C(C=C1)CN2CCN(C(C2)CCO)CC3=CSC=C3

InChI

InChI=1S/C20H24N2OS/c1-2-17-3-5-18(6-4-17)13-21-9-10-22(20(15-21)7-11-23)14-19-8-12-24-16-19/h1,3-6,8,12,16,20,23H,7,9-11,13-15H2