4-[4-[[3-(2-hydroxyethyl)-4-(thiophen-2-ylmethyl)piperazin-1-yl]methyl]phenyl]but-3-yn-1-ol

Systemtic Name: 4-[4-[[3-(2-hydroxyethyl)-4-(thiophen-2-ylmethyl)piperazin-1-yl]methyl]phenyl]but-3-yn-1-ol Openeye Name: 4-[4-[[3-(2-hydroxyethyl)-4-(2-thienylmethyl)piperazin-1-yl]methyl]phenyl]but-3-yn-1-ol CAS Name: 4-[4-[[3-(2-hydroxyethyl)-4-(thiophen-2-ylmethyl)-1-piperazinyl]methyl]phenyl]-3-butyn-1-ol IUPAC Name: 4-[4-[[3-(2-hydroxyethyl)-4-(thiophen-2-ylmethyl)piperazin-1-yl]methyl]phenyl]but-3-yn-1-ol Traditional Name: 4-[4-[[3-(2-hydroxyethyl)-4-(2-thenyl)piperazino]methyl]phenyl]but-3-yn-1-ol Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1CC2=CC=C(C=C2)C#CCCO)CCO)CC3=CC=CS3

Isomeric SMILES

C1CN(C(CN1CC2=CC=C(C=C2)C#CCCO)CCO)CC3=CC=CS3

InChI

InChI=1S/C22H28N2O2S/c25-13-2-1-4-19-6-8-20(9-7-19)16-23-11-12-24(21(17-23)10-14-26)18-22-5-3-15-27-22/h3,5-9,15,21,25-26H,2,10-14,16-18H2