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

Systemtic Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-3-bromanyl-N-propan-2-yl-benzamide Openeye Name: N-[2-[1,3-benzodioxol-5-ylmethyl(2-thienylmethyl)amino]-2-oxo-ethyl]-3-bromo-N-isopropyl-benzamide CAS Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-3-bromo-N-propan-2-ylbenzamide IUPAC Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-3-bromo-N-propan-2-ylbenzamide Traditional Name: 3-bromo-N-isopropyl-N-[2-keto-2-[piperonyl(2-thenyl)amino]ethyl]benzamide Formula: C25H25BrN2O4S MolecularWeight: 529.446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25BrN2O4S/c1-17(2)28(25(30)19-5-3-6-20(26)12-19)15-24(29)27(14-21-7-4-10-33-21)13-18-8-9-22-23(11-18)32-16-31-22/h3-12,17H,13-16H2,1-2H3