ethyl 2-[[5-(1-benzofuran-2-ylmethoxycarbonylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: ethyl 2-[[5-(1-benzofuran-2-ylmethoxycarbonylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[[5-(benzofuran-2-ylmethoxycarbonylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-[[2-benzofuranylmethoxy(oxo)methyl]amino]-1,3,4-thiadiazol-2-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[5-(1-benzofuran-2-ylmethoxycarbonylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-(benzofuran-2-ylmethoxycarbonylamino)-1,3,4-thiadiazol-2-yl]thio]acetic acid ethyl ester Formula: C16H15N3O5S2 MolecularWeight: 393.4374

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NN=C(S1)NC(=O)OCC2=CC3=CC=CC=C3O2

Isomeric SMILES

CCOC(=O)CSC1=NN=C(S1)NC(=O)OCC2=CC3=CC=CC=C3O2

InChI

InChI=1S/C16H15N3O5S2/c1-2-22-13(20)9-25-16-19-18-14(26-16)17-15(21)23-8-11-7-10-5-3-4-6-12(10)24-11/h3-7H,2,8-9H2,1H3,(H,17,18,21)