propyl 4-[2-[1,6-bis(bromanyl)naphthalen-2-yl]oxyethanoylcarbamothioylamino]benzoate

Systemtic Name: propyl 4-[2-[1,6-bis(bromanyl)naphthalen-2-yl]oxyethanoylcarbamothioylamino]benzoate Openeye Name: propyl 4-[[2-[(1,6-dibromo-2-naphthyl)oxy]acetyl]carbamothioylamino]benzoate CAS Name: 4-[[[[2-[(1,6-dibromo-2-naphthalenyl)oxy]-1-oxoethyl]amino]-sulfanylidenemethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[2-(1,6-dibromonaphthalen-2-yl)oxyacetyl]carbamothioylamino]benzoate Traditional Name: 4-[[2-(1,6-dibromo-2-naphthoxy)acetyl]thiocarbamoylamino]benzoic acid propyl ester Formula: C23H20Br2N2O4S MolecularWeight: 580.2889

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20Br2N2O4S/c1-2-11-30-22(29)14-3-7-17(8-4-14)26-23(32)27-20(28)13-31-19-10-5-15-12-16(24)6-9-18(15)21(19)25/h3-10,12H,2,11,13H2,1H3,(H2,26,27,28,32)