methyl 2-methyl-2-[4-[3-methyl-4-(1,3-thiazol-2-yl)phenyl]piperidin-1-yl]sulfonyl-propanoate

Systemtic Name: methyl 2-methyl-2-[4-[3-methyl-4-(1,3-thiazol-2-yl)phenyl]piperidin-1-yl]sulfonyl-propanoate Openeye Name: methyl 2-methyl-2-[[4-(3-methyl-4-thiazol-2-yl-phenyl)-1-piperidyl]sulfonyl]propanoate CAS Name: 2-methyl-2-[[4-[3-methyl-4-(2-thiazolyl)phenyl]-1-piperidinyl]sulfonyl]propanoic acid methyl ester IUPAC Name: methyl 2-methyl-2-[4-[3-methyl-4-(1,3-thiazol-2-yl)phenyl]piperidin-1-yl]sulfonylpropanoate Traditional Name: 2-methyl-2-[4-(3-methyl-4-thiazol-2-yl-phenyl)piperidino]sulfonyl-propionic acid methyl ester Formula: C20H26N2O4S2 MolecularWeight: 422.56144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2CCN(CC2)S(=O)(=O)C(C)(C)C(=O)OC)C3=NC=CS3

Isomeric SMILES

CC1=C(C=CC(=C1)C2CCN(CC2)S(=O)(=O)C(C)(C)C(=O)OC)C3=NC=CS3

InChI

InChI=1S/C20H26N2O4S2/c1-14-13-16(5-6-17(14)18-21-9-12-27-18)15-7-10-22(11-8-15)28(24,25)20(2,3)19(23)26-4/h5-6,9,12-13,15H,7-8,10-11H2,1-4H3