ethyl 4-[5-(1,3-benzoxazol-2-ylsulfanylmethyl)furan-2-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[5-(1,3-benzoxazol-2-ylsulfanylmethyl)furan-2-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[5-(1,3-benzoxazol-2-ylsulfanylmethyl)furan-2-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[5-[(1,3-benzoxazol-2-ylthio)methyl]-2-furanyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-(1,3-benzoxazol-2-ylsulfanylmethyl)furan-2-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[5-[(1,3-benzoxazol-2-ylthio)methyl]-2-furoyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(O2)CSC3=NC4=CC=CC=C4O3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(O2)CSC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C20H21N3O5S/c1-2-26-20(25)23-11-9-22(10-12-23)18(24)17-8-7-14(27-17)13-29-19-21-15-5-3-4-6-16(15)28-19/h3-8H,2,9-13H2,1H3