3-bromanyl-4-(2-methoxyethoxy)-N-[(3-nitrophenyl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-(2-methoxyethoxy)-N-[(3-nitrophenyl)carbamothioyl]benzamide Openeye Name: 3-bromo-4-(2-methoxyethoxy)-N-[(3-nitrophenyl)carbamothioyl]benzamide CAS Name: 3-bromo-4-(2-methoxyethoxy)-N-[(3-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-(2-methoxyethoxy)-N-[(3-nitrophenyl)carbamothioyl]benzamide Traditional Name: 3-bromo-4-(2-methoxyethoxy)-N-[(3-nitrophenyl)thiocarbamoyl]benzamide Formula: C17H16BrN3O5S MolecularWeight: 454.29504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrN3O5S/c1-25-7-8-26-15-6-5-11(9-14(15)18)16(22)20-17(27)19-12-3-2-4-13(10-12)21(23)24/h2-6,9-10H,7-8H2,1H3,(H2,19,20,22,27)