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

Systemtic Name: N-[[4-(2-methoxyethylcarbamoyl)phenyl]carbamothioyl]-3-nitro-benzamide Openeye Name: N-[[4-(2-methoxyethylcarbamoyl)phenyl]carbamothioyl]-3-nitro-benzamide CAS Name: N-[[4-[(2-methoxyethylamino)-oxomethyl]anilino]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: N-[[4-(2-methoxyethylcarbamoyl)phenyl]carbamothioyl]-3-nitrobenzamide Traditional Name: N-[[4-(2-methoxyethylcarbamoyl)phenyl]thiocarbamoyl]-3-nitro-benzamide Formula: C18H18N4O5S MolecularWeight: 402.42432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O5S/c1-27-10-9-19-16(23)12-5-7-14(8-6-12)20-18(28)21-17(24)13-3-2-4-15(11-13)22(25)26/h2-8,11H,9-10H2,1H3,(H,19,23)(H2,20,21,24,28)