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

Systemtic Name: N-[(4-chloranyl-2-nitro-phenyl)carbamothioyl]-4-(2-ethoxyethoxy)benzamide Openeye Name: N-[(4-chloro-2-nitro-phenyl)carbamothioyl]-4-(2-ethoxyethoxy)benzamide CAS Name: N-[(4-chloro-2-nitroanilino)-sulfanylidenemethyl]-4-(2-ethoxyethoxy)benzamide IUPAC Name: N-[(4-chloro-2-nitrophenyl)carbamothioyl]-4-(2-ethoxyethoxy)benzamide Traditional Name: N-[(4-chloro-2-nitro-phenyl)thiocarbamoyl]-4-(2-ethoxyethoxy)benzamide Formula: C18H18ClN3O5S MolecularWeight: 423.87062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18ClN3O5S/c1-2-26-9-10-27-14-6-3-12(4-7-14)17(23)21-18(28)20-15-8-5-13(19)11-16(15)22(24)25/h3-8,11H,2,9-10H2,1H3,(H2,20,21,23,28)