ethyl 2-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-1,2,4-thiadiazol-3-yl]-3-oxidanyl-nonanoate

Systemtic Name: ethyl 2-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-1,2,4-thiadiazol-3-yl]-3-oxidanyl-nonanoate Openeye Name: ethyl 2-[5-(tert-butoxycarbonylamino)-1,2,4-thiadiazol-3-yl]-3-hydroxy-nonanoate CAS Name: 3-hydroxy-2-[5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1,2,4-thiadiazol-3-yl]nonanoic acid ethyl ester IUPAC Name: ethyl 3-hydroxy-2-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-1,2,4-thiadiazol-3-yl]nonanoate Traditional Name: 2-[5-(tert-butoxycarbonylamino)-1,2,4-thiadiazol-3-yl]-3-hydroxy-pelargonic acid ethyl ester Formula: C18H31N3O5S MolecularWeight: 401.52084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(C1=NSC(=N1)NC(=O)OC(C)(C)C)C(=O)OCC)O

Isomeric SMILES

CCCCCCC(C(C1=NSC(=N1)NC(=O)OC(C)(C)C)C(=O)OCC)O

InChI

InChI=1S/C18H31N3O5S/c1-6-8-9-10-11-12(22)13(15(23)25-7-2)14-19-16(27-21-14)20-17(24)26-18(3,4)5/h12-13,22H,6-11H2,1-5H3,(H,19,20,21,24)