dimethyl 5-[(4-bromanyl-3-methoxy-naphthalen-2-yl)carbonylcarbamothioylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(4-bromanyl-3-methoxy-naphthalen-2-yl)carbonylcarbamothioylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(4-bromo-3-methoxy-naphthalene-2-carbonyl)carbamothioylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[[[(4-bromo-3-methoxy-2-naphthalenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(4-bromo-3-methoxynaphthalene-2-carbonyl)carbamothioylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[(4-bromo-3-methoxy-2-naphthoyl)thiocarbamoylamino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C23H19BrN2O6S MolecularWeight: 531.37576

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=CC=CC=C2C=C1C(=O)NC(=S)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC)Br

Isomeric SMILES

COC1=C(C2=CC=CC=C2C=C1C(=O)NC(=S)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC)Br

InChI

InChI=1S/C23H19BrN2O6S/c1-30-19-17(11-12-6-4-5-7-16(12)18(19)24)20(27)26-23(33)25-15-9-13(21(28)31-2)8-14(10-15)22(29)32-3/h4-11H,1-3H3,(H2,25,26,27,33)