3-bromanyl-4-(2-methoxyethoxy)-N-[(4-methoxy-2-nitro-phenyl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-(2-methoxyethoxy)-N-[(4-methoxy-2-nitro-phenyl)carbamothioyl]benzamide Openeye Name: 3-bromo-4-(2-methoxyethoxy)-N-[(4-methoxy-2-nitro-phenyl)carbamothioyl]benzamide CAS Name: 3-bromo-4-(2-methoxyethoxy)-N-[(4-methoxy-2-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-(2-methoxyethoxy)-N-[(4-methoxy-2-nitrophenyl)carbamothioyl]benzamide Traditional Name: 3-bromo-4-(2-methoxyethoxy)-N-[(4-methoxy-2-nitro-phenyl)thiocarbamoyl]benzamide Formula: C18H18BrN3O6S MolecularWeight: 484.32102

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)OC)[N+](=O)[O-])Br

Isomeric SMILES

COCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)OC)[N+](=O)[O-])Br

InChI

InChI=1S/C18H18BrN3O6S/c1-26-7-8-28-16-6-3-11(9-13(16)19)17(23)21-18(29)20-14-5-4-12(27-2)10-15(14)22(24)25/h3-6,9-10H,7-8H2,1-2H3,(H2,20,21,23,29)