N-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-1-(2,5-dimethylthiophen-3-yl)ethanamine

Systemtic Name: N-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-1-(2,5-dimethylthiophen-3-yl)ethanamine Openeye Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-1-(2,5-dimethyl-3-thienyl)ethanamine CAS Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-1-(2,5-dimethyl-3-thiophenyl)ethanamine IUPAC Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-1-(2,5-dimethylthiophen-3-yl)ethanamine Traditional Name: (6-bromo-1,3-benzodioxol-5-yl)methyl-[1-(2,5-dimethyl-3-thienyl)ethyl]amine Formula: C16H18BrNO2S MolecularWeight: 368.28862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(C)NCC2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

CC1=CC(=C(S1)C)C(C)NCC2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C16H18BrNO2S/c1-9-4-13(11(3)21-9)10(2)18-7-12-5-15-16(6-14(12)17)20-8-19-15/h4-6,10,18H,7-8H2,1-3H3