N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-3-(ethylsulfonylamino)benzamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-3-(ethylsulfonylamino)benzamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiazol-2-yl]-3-(ethylsulfonylamino)benzamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-thiazolyl]-3-(ethylsulfonylamino)benzamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-3-(ethylsulfonylamino)benzamide Traditional Name: 3-(esylamino)-N-(4-methyl-5-piperonyl-thiazol-2-yl)benzamide Formula: C21H21N3O5S2 MolecularWeight: 459.53854

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1=CC=CC(=C1)C(=O)NC2=NC(=C(S2)CC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CCS(=O)(=O)NC1=CC=CC(=C1)C(=O)NC2=NC(=C(S2)CC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C21H21N3O5S2/c1-3-31(26,27)24-16-6-4-5-15(11-16)20(25)23-21-22-13(2)19(30-21)10-14-7-8-17-18(9-14)29-12-28-17/h4-9,11,24H,3,10,12H2,1-2H3,(H,22,23,25)