N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-bromo-2-thienyl)methyl-ethyl-amino]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-bromo-2-thiophenyl)methyl-ethylamino]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-bromothiophen-2-yl)methyl-ethylamino]acetamide Traditional Name: 2-[(5-bromo-2-thienyl)methyl-ethyl-amino]-N-piperonyl-acetamide Formula: C17H19BrN2O3S MolecularWeight: 411.31336

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(S1)Br)CC(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCN(CC1=CC=C(S1)Br)CC(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H19BrN2O3S/c1-2-20(9-13-4-6-16(18)24-13)10-17(21)19-8-12-3-5-14-15(7-12)23-11-22-14/h3-7H,2,8-11H2,1H3,(H,19,21)