butyl 4-[(4-bromanyl-3-methoxy-naphthalen-2-yl)carbonylcarbamothioylamino]benzoate

Systemtic Name: butyl 4-[(4-bromanyl-3-methoxy-naphthalen-2-yl)carbonylcarbamothioylamino]benzoate Openeye Name: butyl 4-[(4-bromo-3-methoxy-naphthalene-2-carbonyl)carbamothioylamino]benzoate CAS Name: 4-[[[[(4-bromo-3-methoxy-2-naphthalenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(4-bromo-3-methoxynaphthalene-2-carbonyl)carbamothioylamino]benzoate Traditional Name: 4-[(4-bromo-3-methoxy-2-naphthoyl)thiocarbamoylamino]benzoic acid butyl ester Formula: C24H23BrN2O4S MolecularWeight: 515.41942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3C(=C2OC)Br

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3C(=C2OC)Br

InChI

InChI=1S/C24H23BrN2O4S/c1-3-4-13-31-23(29)15-9-11-17(12-10-15)26-24(32)27-22(28)19-14-16-7-5-6-8-18(16)20(25)21(19)30-2/h5-12,14H,3-4,13H2,1-2H3,(H2,26,27,28,32)