N-[(7-bromanyl-1,3-benzodioxol-5-yl)methyl]-1-thiophen-2-yl-methanamine

Systemtic Name: N-[(7-bromanyl-1,3-benzodioxol-5-yl)methyl]-1-thiophen-2-yl-methanamine Openeye Name: N-[(7-bromo-1,3-benzodioxol-5-yl)methyl]-1-(2-thienyl)methanamine CAS Name: N-[(7-bromo-1,3-benzodioxol-5-yl)methyl]-1-thiophen-2-ylmethanamine IUPAC Name: N-[(7-bromo-1,3-benzodioxol-5-yl)methyl]-1-thiophen-2-ylmethanamine Traditional Name: (7-bromo-1,3-benzodioxol-5-yl)methyl-(2-thenyl)amine Formula: C13H12BrNO2S MolecularWeight: 326.20888

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)CNCC3=CC=CS3)Br

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)CNCC3=CC=CS3)Br

InChI

InChI=1S/C13H12BrNO2S/c14-11-4-9(5-12-13(11)17-8-16-12)6-15-7-10-2-1-3-18-10/h1-5,15H,6-8H2