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

Systemtic Name: ethanedioic acid; 1-phenyl-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]methanamine Openeye Name: oxalic acid; 1-phenyl-N-[(2-phenylthiazol-4-yl)methyl]methanamine CAS Name: oxalic acid; 1-phenyl-N-[(2-phenyl-4-thiazolyl)methyl]methanamine IUPAC Name: oxalic acid; 1-phenyl-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]methanamine Traditional Name: benzyl-[(2-phenylthiazol-4-yl)methyl]amine; oxalic acid Formula: C19H18N2O4S MolecularWeight: 370.42222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCC2=CSC(=N2)C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CNCC2=CSC(=N2)C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H16N2S.C2H2O4/c1-3-7-14(8-4-1)11-18-12-16-13-20-17(19-16)15-9-5-2-6-10-15;3-1(4)2(5)6/h1-10,13,18H,11-12H2;(H,3,4)(H,5,6)