4-[5-[[3-(2-hydroxyethyl)-4-(1-methylpiperidin-4-yl)piperazin-1-yl]methyl]thiophen-2-yl]-2-methyl-but-3-yn-2-ol

Systemtic Name: 4-[5-[[3-(2-hydroxyethyl)-4-(1-methylpiperidin-4-yl)piperazin-1-yl]methyl]thiophen-2-yl]-2-methyl-but-3-yn-2-ol Openeye Name: 4-[5-[[3-(2-hydroxyethyl)-4-(1-methyl-4-piperidyl)piperazin-1-yl]methyl]-2-thienyl]-2-methyl-but-3-yn-2-ol CAS Name: 4-[5-[[3-(2-hydroxyethyl)-4-(1-methyl-4-piperidinyl)-1-piperazinyl]methyl]-2-thiophenyl]-2-methyl-3-butyn-2-ol IUPAC Name: 4-[5-[[3-(2-hydroxyethyl)-4-(1-methylpiperidin-4-yl)piperazin-1-yl]methyl]thiophen-2-yl]-2-methylbut-3-yn-2-ol Traditional Name: 4-[5-[[3-(2-hydroxyethyl)-4-(1-methyl-4-piperidyl)piperazino]methyl]-2-thienyl]-2-methyl-but-3-yn-2-ol Formula: C22H35N3O2S MolecularWeight: 405.5972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=CC=C(S1)CN2CCN(C(C2)CCO)C3CCN(CC3)C)O

Isomeric SMILES

CC(C)(C#CC1=CC=C(S1)CN2CCN(C(C2)CCO)C3CCN(CC3)C)O

InChI

InChI=1S/C22H35N3O2S/c1-22(2,27)10-6-20-4-5-21(28-20)17-24-13-14-25(19(16-24)9-15-26)18-7-11-23(3)12-8-18/h4-5,18-19,26-27H,7-9,11-17H2,1-3H3