[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl] 2-(hydroxymethyl)-3,3-dimethyl-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: [5-(pyrrolidin-1-ylmethyl)thiophen-2-yl] 2-(hydroxymethyl)-3,3-dimethyl-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: [5-(pyrrolidin-1-ylmethyl)-2-thienyl] 2-(benzyloxycarbonylamino)-2-(hydroxymethyl)-3,3-dimethyl-butanoate CAS Name: 2-(hydroxymethyl)-3,3-dimethyl-2-(phenylmethoxycarbonylamino)butanoic acid [5-(1-pyrrolidinylmethyl)-2-thiophenyl] ester IUPAC Name: [5-(pyrrolidin-1-ylmethyl)thiophen-2-yl] 2-(hydroxymethyl)-3,3-dimethyl-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: 2-(benzyloxycarbonylamino)-3,3-dimethyl-2-methylol-butyric acid [5-(pyrrolidinomethyl)-2-thienyl] ester Formula: C24H32N2O5S MolecularWeight: 460.58628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CO)(C(=O)OC1=CC=C(S1)CN2CCCC2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(CO)(C(=O)OC1=CC=C(S1)CN2CCCC2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H32N2O5S/c1-23(2,3)24(17-27,25-22(29)30-16-18-9-5-4-6-10-18)21(28)31-20-12-11-19(32-20)15-26-13-7-8-14-26/h4-6,9-12,27H,7-8,13-17H2,1-3H3,(H,25,29)