N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-4-bromanyl-N-(2-methoxyethyl)benzamide

Systemtic Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-4-bromanyl-N-(2-methoxyethyl)benzamide Openeye Name: N-[2-[1,3-benzodioxol-5-ylmethyl(2-thienylmethyl)amino]-2-oxo-ethyl]-4-bromo-N-(2-methoxyethyl)benzamide CAS Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-4-bromo-N-(2-methoxyethyl)benzamide IUPAC Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-4-bromo-N-(2-methoxyethyl)benzamide Traditional Name: 4-bromo-N-[2-keto-2-[piperonyl(2-thenyl)amino]ethyl]-N-(2-methoxyethyl)benzamide Formula: C25H25BrN2O5S MolecularWeight: 545.4454

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

COCCN(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H25BrN2O5S/c1-31-11-10-27(25(30)19-5-7-20(26)8-6-19)16-24(29)28(15-21-3-2-12-34-21)14-18-4-9-22-23(13-18)33-17-32-22/h2-9,12-13H,10-11,14-17H2,1H3