4-ethoxy-N-[(4-ethylphenyl)carbamothioyl]-3-nitro-benzamide

Systemtic Name: 4-ethoxy-N-[(4-ethylphenyl)carbamothioyl]-3-nitro-benzamide Openeye Name: 4-ethoxy-N-[(4-ethylphenyl)carbamothioyl]-3-nitro-benzamide CAS Name: 4-ethoxy-N-[(4-ethylanilino)-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: 4-ethoxy-N-[(4-ethylphenyl)carbamothioyl]-3-nitrobenzamide Traditional Name: 4-ethoxy-N-[(4-ethylphenyl)thiocarbamoyl]-3-nitro-benzamide Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCC)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCC)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O4S/c1-3-12-5-8-14(9-6-12)19-18(26)20-17(22)13-7-10-16(25-4-2)15(11-13)21(23)24/h5-11H,3-4H2,1-2H3,(H2,19,20,22,26)