N-[[2-[1,6-bis(bromanyl)naphthalen-2-yl]oxyethanoylamino]carbamothioyl]-3-butoxy-benzamide

Systemtic Name: N-[[2-[1,6-bis(bromanyl)naphthalen-2-yl]oxyethanoylamino]carbamothioyl]-3-butoxy-benzamide Openeye Name: 3-butoxy-N-[[[2-[(1,6-dibromo-2-naphthyl)oxy]acetyl]amino]carbamothioyl]benzamide CAS Name: 3-butoxy-N-[[[2-[(1,6-dibromo-2-naphthalenyl)oxy]-1-oxoethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[[[2-(1,6-dibromonaphthalen-2-yl)oxyacetyl]amino]carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[[[2-(1,6-dibromo-2-naphthoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C24H23Br2N3O4S MolecularWeight: 609.33012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)COC2=C(C3=C(C=C2)C=C(C=C3)Br)Br

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)COC2=C(C3=C(C=C2)C=C(C=C3)Br)Br

InChI

InChI=1S/C24H23Br2N3O4S/c1-2-3-11-32-18-6-4-5-16(13-18)23(31)27-24(34)29-28-21(30)14-33-20-10-7-15-12-17(25)8-9-19(15)22(20)26/h4-10,12-13H,2-3,11,14H2,1H3,(H,28,30)(H2,27,29,31,34)