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

Systemtic Name: N-[(2-nitrophenyl)carbamothioyl]-4-(2-phenoxyethoxy)benzamide Openeye Name: N-[(2-nitrophenyl)carbamothioyl]-4-(2-phenoxyethoxy)benzamide CAS Name: N-[(2-nitroanilino)-sulfanylidenemethyl]-4-(2-phenoxyethoxy)benzamide IUPAC Name: N-[(2-nitrophenyl)carbamothioyl]-4-(2-phenoxyethoxy)benzamide Traditional Name: N-[(2-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=CC=C3[N+](=O)[O-]

Isomeric SMILES

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

InChI

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