N-[(4-nitrophenyl)carbamothioyl]-4-(2-phenoxyethoxy)benzamide

Systemtic Name: N-[(4-nitrophenyl)carbamothioyl]-4-(2-phenoxyethoxy)benzamide Openeye Name: N-[(4-nitrophenyl)carbamothioyl]-4-(2-phenoxyethoxy)benzamide CAS Name: N-[(4-nitroanilino)-sulfanylidenemethyl]-4-(2-phenoxyethoxy)benzamide IUPAC Name: N-[(4-nitrophenyl)carbamothioyl]-4-(2-phenoxyethoxy)benzamide Traditional Name: N-[(4-nitrophenyl)thiocarbamoyl]-4-(2-phenoxyethoxy)benzamide Formula: C22H19N3O5S MolecularWeight: 437.46836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCOC2=CC=C(C=C2)C(=O)NC(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCCOC2=CC=C(C=C2)C(=O)NC(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O5S/c26-21(24-22(31)23-17-8-10-18(11-9-17)25(27)28)16-6-12-20(13-7-16)30-15-14-29-19-4-2-1-3-5-19/h1-13H,14-15H2,(H2,23,24,26,31)