[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl 2-methyl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: [2-(furan-2-yl)-1,3-thiazol-4-yl]methyl 2-methyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: [2-(2-furyl)thiazol-4-yl]methyl 2-methyl-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-methyl-5-(1-piperidinylsulfonyl)benzoic acid [2-(2-furanyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(furan-2-yl)-1,3-thiazol-4-yl]methyl 2-methyl-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-methyl-5-piperidinosulfonyl-benzoic acid [2-(2-furyl)thiazol-4-yl]methyl ester Formula: C21H22N2O5S2 MolecularWeight: 446.53978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)OCC3=CSC(=N3)C4=CC=CO4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)OCC3=CSC(=N3)C4=CC=CO4

InChI

InChI=1S/C21H22N2O5S2/c1-15-7-8-17(30(25,26)23-9-3-2-4-10-23)12-18(15)21(24)28-13-16-14-29-20(22-16)19-6-5-11-27-19/h5-8,11-12,14H,2-4,9-10,13H2,1H3