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

Systemtic Name: N-[(4-bromanylthiophen-2-yl)methyl]-1-phenyl-methanamine; ethanedioic acid Openeye Name: N-[(4-bromo-2-thienyl)methyl]-1-phenyl-methanamine; oxalic acid CAS Name: N-[(4-bromo-2-thiophenyl)methyl]-1-phenylmethanamine; oxalic acid IUPAC Name: N-[(4-bromothiophen-2-yl)methyl]-1-phenylmethanamine; oxalic acid Traditional Name: benzyl-[(4-bromo-2-thienyl)methyl]amine; oxalic acid Formula: C14H14BrNO4S MolecularWeight: 372.23426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCC2=CC(=CS2)Br.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CNCC2=CC(=CS2)Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C12H12BrNS.C2H2O4/c13-11-6-12(15-9-11)8-14-7-10-4-2-1-3-5-10;3-1(4)2(5)6/h1-6,9,14H,7-8H2;(H,3,4)(H,5,6)