4-[5-[[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidin-1-yl]methyl]thiophen-2-yl]-2-methyl-but-3-yn-2-ol

Systemtic Name: 4-[5-[[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidin-1-yl]methyl]thiophen-2-yl]-2-methyl-but-3-yn-2-ol Openeye Name: 4-[5-[[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-piperidyl]methyl]-2-thienyl]-2-methyl-but-3-yn-2-ol CAS Name: 4-[5-[[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-piperidinyl]methyl]-2-thiophenyl]-2-methyl-3-butyn-2-ol IUPAC Name: 4-[5-[[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidin-1-yl]methyl]thiophen-2-yl]-2-methylbut-3-yn-2-ol Traditional Name: 4-[5-[[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidino]methyl]-2-thienyl]-2-methyl-but-3-yn-2-ol Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=CC=C(S1)CN2CCCC(C2)NC3=CC4=C(C=C3)OCCO4)O

Isomeric SMILES

CC(C)(C#CC1=CC=C(S1)CN2CCCC(C2)NC3=CC4=C(C=C3)OCCO4)O

InChI

InChI=1S/C23H28N2O3S/c1-23(2,26)10-9-19-6-7-20(29-19)16-25-11-3-4-18(15-25)24-17-5-8-21-22(14-17)28-13-12-27-21/h5-8,14,18,24,26H,3-4,11-13,15-16H2,1-2H3