[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]methyl 3-piperidin-1-ylsulfonylbenzoate

Systemtic Name: [2-(3-methoxyphenyl)-1,3-thiazol-4-yl]methyl 3-piperidin-1-ylsulfonylbenzoate Openeye Name: [2-(3-methoxyphenyl)thiazol-4-yl]methyl 3-(1-piperidylsulfonyl)benzoate CAS Name: 3-(1-piperidinylsulfonyl)benzoic acid [2-(3-methoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(3-methoxyphenyl)-1,3-thiazol-4-yl]methyl 3-piperidin-1-ylsulfonylbenzoate Traditional Name: 3-piperidinosulfonylbenzoic acid [2-(3-methoxyphenyl)thiazol-4-yl]methyl ester Formula: C23H24N2O5S2 MolecularWeight: 472.57706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NC(=CS2)COC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC1=CC=CC(=C1)C2=NC(=CS2)COC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C23H24N2O5S2/c1-29-20-9-5-7-17(13-20)22-24-19(16-31-22)15-30-23(26)18-8-6-10-21(14-18)32(27,28)25-11-3-2-4-12-25/h5-10,13-14,16H,2-4,11-12,15H2,1H3