2-(methylamino)-1-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]propane-1,3-diol

Systemtic Name: 2-(methylamino)-1-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]propane-1,3-diol Openeye Name: 2-(methylamino)-1-[5-(pyrrolidin-1-ylmethyl)-2-thienyl]propane-1,3-diol CAS Name: 2-(methylamino)-1-[5-(1-pyrrolidinylmethyl)-2-thiophenyl]propane-1,3-diol IUPAC Name: 2-(methylamino)-1-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]propane-1,3-diol Traditional Name: 2-(methylamino)-1-[5-(pyrrolidinomethyl)-2-thienyl]propane-1,3-diol Formula: C13H22N2O2S MolecularWeight: 270.39098

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Descriptors Computed from Structure

Canonical SMILES:

CNC(CO)C(C1=CC=C(S1)CN2CCCC2)O

Isomeric SMILES

CNC(CO)C(C1=CC=C(S1)CN2CCCC2)O

InChI

InChI=1S/C13H22N2O2S/c1-14-11(9-16)13(17)12-5-4-10(18-12)8-15-6-2-3-7-15/h4-5,11,13-14,16-17H,2-3,6-9H2,1H3