3-(2-ethoxyethoxy)-N-[(2-methyl-4-nitro-phenyl)carbamothioyl]benzamide

Systemtic Name: 3-(2-ethoxyethoxy)-N-[(2-methyl-4-nitro-phenyl)carbamothioyl]benzamide Openeye Name: 3-(2-ethoxyethoxy)-N-[(2-methyl-4-nitro-phenyl)carbamothioyl]benzamide CAS Name: 3-(2-ethoxyethoxy)-N-[(2-methyl-4-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-(2-ethoxyethoxy)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]benzamide Traditional Name: 3-(2-ethoxyethoxy)-N-[(2-methyl-4-nitro-phenyl)thiocarbamoyl]benzamide Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCOCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C19H21N3O5S/c1-3-26-9-10-27-16-6-4-5-14(12-16)18(23)21-19(28)20-17-8-7-15(22(24)25)11-13(17)2/h4-8,11-12H,3,9-10H2,1-2H3,(H2,20,21,23,28)