propan-2-yl 3-[2-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methyl]-1,2,3,4-tetrazol-5-yl]benzoate

Systemtic Name: propan-2-yl 3-[2-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methyl]-1,2,3,4-tetrazol-5-yl]benzoate Openeye Name: isopropyl 3-[2-[(5-pyrrolidin-1-ylsulfonyl-2-furyl)methyl]tetrazol-5-yl]benzoate CAS Name: 3-[2-[[5-(1-pyrrolidinylsulfonyl)-2-furanyl]methyl]-5-tetrazolyl]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[2-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methyl]tetrazol-5-yl]benzoate Traditional Name: 3-[2-[(5-pyrrolidinosulfonyl-2-furyl)methyl]tetrazol-5-yl]benzoic acid isopropyl ester Formula: C20H23N5O5S MolecularWeight: 445.49212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=CC(=C1)C2=NN(N=N2)CC3=CC=C(O3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC(C)OC(=O)C1=CC=CC(=C1)C2=NN(N=N2)CC3=CC=C(O3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C20H23N5O5S/c1-14(2)29-20(26)16-7-5-6-15(12-16)19-21-23-25(22-19)13-17-8-9-18(30-17)31(27,28)24-10-3-4-11-24/h5-9,12,14H,3-4,10-11,13H2,1-2H3