2-(azepan-1-yl)-N-(4-methyl-1,3-thiazol-2-yl)ethanamide; ethanedioic acid

Systemtic Name: 2-(azepan-1-yl)-N-(4-methyl-1,3-thiazol-2-yl)ethanamide; ethanedioic acid Openeye Name: 2-(azepan-1-yl)-N-(4-methylthiazol-2-yl)acetamide; oxalic acid CAS Name: 2-(1-azepanyl)-N-(4-methyl-2-thiazolyl)acetamide; oxalic acid IUPAC Name: 2-(azepan-1-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide; oxalic acid Traditional Name: 2-(azepan-1-yl)-N-(4-methylthiazol-2-yl)acetamide; oxalic acid Formula: C14H21N3O5S MolecularWeight: 343.39864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)CN2CCCCCC2.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CSC(=N1)NC(=O)CN2CCCCCC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C12H19N3OS.C2H2O4/c1-10-9-17-12(13-10)14-11(16)8-15-6-4-2-3-5-7-15;3-1(4)2(5)6/h9H,2-8H2,1H3,(H,13,14,16);(H,3,4)(H,5,6)