N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-1-methylsulfonyl-piperidine-2-carboxamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-1-methylsulfonyl-piperidine-2-carboxamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiazol-2-yl]-1-methylsulfonyl-piperidine-2-carboxamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-thiazolyl]-1-methylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-1-methylsulfonylpiperidine-2-carboxamide Traditional Name: 1-mesyl-N-(4-methyl-5-piperonyl-thiazol-2-yl)pipecolinamide Formula: C19H23N3O5S2 MolecularWeight: 437.53302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2CCCCN2S(=O)(=O)C)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2CCCCN2S(=O)(=O)C)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H23N3O5S2/c1-12-17(10-13-6-7-15-16(9-13)27-11-26-15)28-19(20-12)21-18(23)14-5-3-4-8-22(14)29(2,24)25/h6-7,9,14H,3-5,8,10-11H2,1-2H3,(H,20,21,23)