2-[2-(2-diethylaminoethylamino)-4-thiophen-2-yl-1,3-thiazol-5-yl]ethanoic acid; ethanedioic acid

Systemtic Name: 2-[2-(2-diethylaminoethylamino)-4-thiophen-2-yl-1,3-thiazol-5-yl]ethanoic acid; ethanedioic acid Openeye Name: 2-[2-(2-diethylaminoethylamino)-4-(2-thienyl)thiazol-5-yl]acetic acid; oxalic acid CAS Name: 2-[2-(2-diethylaminoethylamino)-4-thiophen-2-yl-5-thiazolyl]acetic acid; oxalic acid IUPAC Name: 2-[2-(2-diethylaminoethylamino)-4-thiophen-2-yl-1,3-thiazol-5-yl]acetic acid; oxalic acid Traditional Name: 2-[2-(2-diethylaminoethylamino)-4-(2-thienyl)thiazol-5-yl]acetic acid; oxalic acid Formula: C17H23N3O6S2 MolecularWeight: 429.51102

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=NC(=C(S1)CC(=O)O)C2=CC=CS2.C(=O)(C(=O)O)O

Isomeric SMILES

CCN(CC)CCNC1=NC(=C(S1)CC(=O)O)C2=CC=CS2.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H21N3O2S2.C2H2O4/c1-3-18(4-2)8-7-16-15-17-14(11-6-5-9-21-11)12(22-15)10-13(19)20;3-1(4)2(5)6/h5-6,9H,3-4,7-8,10H2,1-2H3,(H,16,17)(H,19,20);(H,3,4)(H,5,6)