ethanedioic acid; 4-[2-(prop-2-enylamino)-1,3-thiazol-4-yl]phenol

Systemtic Name: ethanedioic acid; 4-[2-(prop-2-enylamino)-1,3-thiazol-4-yl]phenol Openeye Name: 4-[2-(allylamino)thiazol-4-yl]phenol; oxalic acid CAS Name: oxalic acid; 4-[2-(prop-2-enylamino)-4-thiazolyl]phenol IUPAC Name: oxalic acid; 4-[2-(prop-2-enylamino)-1,3-thiazol-4-yl]phenol Traditional Name: 4-[2-(allylamino)thiazol-4-yl]phenol; oxalic acid Formula: C14H14N2O5S MolecularWeight: 322.33636

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NC(=CS1)C2=CC=C(C=C2)O.C(=O)(C(=O)O)O

Isomeric SMILES

C=CCNC1=NC(=CS1)C2=CC=C(C=C2)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C12H12N2OS.C2H2O4/c1-2-7-13-12-14-11(8-16-12)9-3-5-10(15)6-4-9;3-1(4)2(5)6/h2-6,8,15H,1,7H2,(H,13,14);(H,3,4)(H,5,6)