propan-2-yl 3-[2-[[5-(5-bromanyl-1-benzofuran-2-yl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]-4-chloranyl-benzoate

Systemtic Name: propan-2-yl 3-[2-[[5-(5-bromanyl-1-benzofuran-2-yl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]-4-chloranyl-benzoate Openeye Name: isopropyl 3-[[2-[[5-(5-bromobenzofuran-2-yl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-4-chloro-benzoate CAS Name: 3-[[2-[[5-(5-bromo-2-benzofuranyl)-4-ethyl-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]-4-chlorobenzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[2-[[5-(5-bromo-1-benzofuran-2-yl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-4-chlorobenzoate Traditional Name: 3-[[2-[[5-(5-bromobenzofuran-2-yl)-4-ethyl-1,2,4-triazol-3-yl]thio]acetyl]amino]-4-chloro-benzoic acid isopropyl ester Formula: C24H22BrClN4O4S MolecularWeight: 577.87788

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)C(=O)OC(C)C)Cl)C3=CC4=C(O3)C=CC(=C4)Br

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)C(=O)OC(C)C)Cl)C3=CC4=C(O3)C=CC(=C4)Br

InChI

InChI=1S/C24H22BrClN4O4S/c1-4-30-22(20-11-15-9-16(25)6-8-19(15)34-20)28-29-24(30)35-12-21(31)27-18-10-14(5-7-17(18)26)23(32)33-13(2)3/h5-11,13H,4,12H2,1-3H3,(H,27,31)