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

Systemtic Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-3-bromanyl-N-(2-methoxyethyl)benzamide Openeye Name: N-[2-[1,3-benzodioxol-5-ylmethyl(2-thienylmethyl)amino]-2-oxo-ethyl]-3-bromo-N-(2-methoxyethyl)benzamide CAS Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-3-bromo-N-(2-methoxyethyl)benzamide IUPAC Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-3-bromo-N-(2-methoxyethyl)benzamide Traditional Name: 3-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(=CC=C4)Br

Isomeric SMILES

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

InChI

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