3-bromanyl-N-[[2-(1-bromanylnaphthalen-2-yl)oxyethanoylamino]carbamothioyl]-4-hexoxy-benzamide

Systemtic Name: 3-bromanyl-N-[[2-(1-bromanylnaphthalen-2-yl)oxyethanoylamino]carbamothioyl]-4-hexoxy-benzamide Openeye Name: 3-bromo-N-[[[2-[(1-bromo-2-naphthyl)oxy]acetyl]amino]carbamothioyl]-4-hexoxy-benzamide CAS Name: 3-bromo-N-[[[2-[(1-bromo-2-naphthalenyl)oxy]-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-4-hexoxybenzamide IUPAC Name: 3-bromo-N-[[[2-(1-bromonaphthalen-2-yl)oxyacetyl]amino]carbamothioyl]-4-hexoxybenzamide Traditional Name: 3-bromo-N-[[[2-(1-bromo-2-naphthoxy)acetyl]amino]thiocarbamoyl]-4-hexoxy-benzamide Formula: C26H27Br2N3O4S MolecularWeight: 637.38328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=C(C3=CC=CC=C3C=C2)Br)Br

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=C(C3=CC=CC=C3C=C2)Br)Br

InChI

InChI=1S/C26H27Br2N3O4S/c1-2-3-4-7-14-34-21-12-11-18(15-20(21)27)25(33)29-26(36)31-30-23(32)16-35-22-13-10-17-8-5-6-9-19(17)24(22)28/h5-6,8-13,15H,2-4,7,14,16H2,1H3,(H,30,32)(H2,29,31,33,36)