(2-methyl-1,3-thiazol-4-yl)methyl 4-methyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (2-methyl-1,3-thiazol-4-yl)methyl 4-methyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: (2-methylthiazol-4-yl)methyl 4-methyl-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-methyl-3-(1-piperidinylsulfonyl)benzoic acid (2-methyl-4-thiazolyl)methyl ester IUPAC Name: (2-methyl-1,3-thiazol-4-yl)methyl 4-methyl-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-methyl-3-piperidinosulfonyl-benzoic acid (2-methylthiazol-4-yl)methyl ester Formula: C18H22N2O4S2 MolecularWeight: 394.50828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC2=CSC(=N2)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC2=CSC(=N2)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H22N2O4S2/c1-13-6-7-15(18(21)24-11-16-12-25-14(2)19-16)10-17(13)26(22,23)20-8-4-3-5-9-20/h6-7,10,12H,3-5,8-9,11H2,1-2H3