N-[(3-nitrophenyl)carbamothioyl]-2-(2-phenoxyethoxy)benzamide

Systemtic Name: N-[(3-nitrophenyl)carbamothioyl]-2-(2-phenoxyethoxy)benzamide Openeye Name: N-[(3-nitrophenyl)carbamothioyl]-2-(2-phenoxyethoxy)benzamide CAS Name: N-[(3-nitroanilino)-sulfanylidenemethyl]-2-(2-phenoxyethoxy)benzamide IUPAC Name: N-[(3-nitrophenyl)carbamothioyl]-2-(2-phenoxyethoxy)benzamide Traditional Name: N-[(3-nitrophenyl)thiocarbamoyl]-2-(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=CC=C2C(=O)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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