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

Systemtic Name: N-[(4-chloranyl-3-nitro-phenyl)carbamothioyl]-2-(2-phenoxyethoxy)benzamide Openeye Name: N-[(4-chloro-3-nitro-phenyl)carbamothioyl]-2-(2-phenoxyethoxy)benzamide CAS Name: N-[(4-chloro-3-nitroanilino)-sulfanylidenemethyl]-2-(2-phenoxyethoxy)benzamide IUPAC Name: N-[(4-chloro-3-nitrophenyl)carbamothioyl]-2-(2-phenoxyethoxy)benzamide Traditional Name: N-[(4-chloro-3-nitro-phenyl)thiocarbamoyl]-2-(2-phenoxyethoxy)benzamide Formula: C22H18ClN3O5S MolecularWeight: 471.91342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCOC2=CC=CC=C2C(=O)NC(=S)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCCOC2=CC=CC=C2C(=O)NC(=S)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H18ClN3O5S/c23-18-11-10-15(14-19(18)26(28)29)24-22(32)25-21(27)17-8-4-5-9-20(17)31-13-12-30-16-6-2-1-3-7-16/h1-11,14H,12-13H2,(H2,24,25,27,32)