1-[4-[[3-(2-hydroxyethyl)-4-(3-phenylpropyl)piperazin-1-yl]methyl]thiophen-2-yl]ethanone

Systemtic Name: 1-[4-[[3-(2-hydroxyethyl)-4-(3-phenylpropyl)piperazin-1-yl]methyl]thiophen-2-yl]ethanone Openeye Name: 1-[4-[[3-(2-hydroxyethyl)-4-(3-phenylpropyl)piperazin-1-yl]methyl]-2-thienyl]ethanone CAS Name: 1-[4-[[3-(2-hydroxyethyl)-4-(3-phenylpropyl)-1-piperazinyl]methyl]-2-thiophenyl]ethanone IUPAC Name: 1-[4-[[3-(2-hydroxyethyl)-4-(3-phenylpropyl)piperazin-1-yl]methyl]thiophen-2-yl]ethanone Traditional Name: 1-[4-[[3-(2-hydroxyethyl)-4-(3-phenylpropyl)piperazino]methyl]-2-thienyl]ethanone Formula: C22H30N2O2S MolecularWeight: 386.5508

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CS1)CN2CCN(C(C2)CCO)CCCC3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC(=CS1)CN2CCN(C(C2)CCO)CCCC3=CC=CC=C3

InChI

InChI=1S/C22H30N2O2S/c1-18(26)22-14-20(17-27-22)15-23-11-12-24(21(16-23)9-13-25)10-5-8-19-6-3-2-4-7-19/h2-4,6-7,14,17,21,25H,5,8-13,15-16H2,1H3