ethyl 4-methyl-5-[(3R)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-methylsulfonyloxy-butyl]thiophene-2-carboxylate

Systemtic Name: ethyl 4-methyl-5-[(3R)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-methylsulfonyloxy-butyl]thiophene-2-carboxylate Openeye Name: ethyl 5-[(3R)-4-(tert-butoxycarbonylamino)-3-methylsulfonyloxy-butyl]-4-methyl-thiophene-2-carboxylate CAS Name: 4-methyl-5-[(3R)-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-methylsulfonyloxybutyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-5-[(3R)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-methylsulfonyloxybutyl]thiophene-2-carboxylate Traditional Name: 5-[(3R)-4-(tert-butoxycarbonylamino)-3-methylsulfonyloxy-butyl]-4-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C18H29NO7S2 MolecularWeight: 435.55536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(S1)CCC(CNC(=O)OC(C)(C)C)OS(=O)(=O)C)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(S1)CC[C@H](CNC(=O)OC(C)(C)C)OS(=O)(=O)C)C

InChI

InChI=1S/C18H29NO7S2/c1-7-24-16(20)15-10-12(2)14(27-15)9-8-13(26-28(6,22)23)11-19-17(21)25-18(3,4)5/h10,13H,7-9,11H2,1-6H3,(H,19,21)/t13-/m1/s1