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

Systemtic Name: [4-methyl-5-(pyrrolidin-1-ylmethyl)thiophen-2-yl] 2-azanyl-2-(hydroxymethyl)-3,3-dimethyl-butanoate Openeye Name: [4-methyl-5-(pyrrolidin-1-ylmethyl)-2-thienyl] 2-amino-2-(hydroxymethyl)-3,3-dimethyl-butanoate CAS Name: 2-amino-2-(hydroxymethyl)-3,3-dimethylbutanoic acid [4-methyl-5-(1-pyrrolidinylmethyl)-2-thiophenyl] ester IUPAC Name: [4-methyl-5-(pyrrolidin-1-ylmethyl)thiophen-2-yl] 2-amino-2-(hydroxymethyl)-3,3-dimethylbutanoate Traditional Name: 2-amino-3,3-dimethyl-2-methylol-butyric acid [4-methyl-5-(pyrrolidinomethyl)-2-thienyl] ester Formula: C17H28N2O3S MolecularWeight: 340.48082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)OC(=O)C(CO)(C(C)(C)C)N)CN2CCCC2

Isomeric SMILES

CC1=C(SC(=C1)OC(=O)C(CO)(C(C)(C)C)N)CN2CCCC2

InChI

InChI=1S/C17H28N2O3S/c1-12-9-14(23-13(12)10-19-7-5-6-8-19)22-15(21)17(18,11-20)16(2,3)4/h9,20H,5-8,10-11,18H2,1-4H3