ethanedioic acid; N-ethyl-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]ethanamine

Systemtic Name: ethanedioic acid; N-ethyl-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]ethanamine Openeye Name: N-ethyl-N-[(4-phenylthiazol-2-yl)methyl]ethanamine; oxalic acid CAS Name: N-ethyl-N-[(4-phenyl-2-thiazolyl)methyl]ethanamine; oxalic acid IUPAC Name: N-ethyl-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]ethanamine; oxalic acid Traditional Name: diethyl-[(4-phenylthiazol-2-yl)methyl]amine; oxalic acid Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=NC(=CS1)C2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CCN(CC)CC1=NC(=CS1)C2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H18N2S.C2H2O4/c1-3-16(4-2)10-14-15-13(11-17-14)12-8-6-5-7-9-12;3-1(4)2(5)6/h5-9,11H,3-4,10H2,1-2H3;(H,3,4)(H,5,6)