N-[(2-methoxy-5-nitro-phenyl)carbamothioyl]-4-(2-phenoxyethoxy)benzamide

Systemtic Name: N-[(2-methoxy-5-nitro-phenyl)carbamothioyl]-4-(2-phenoxyethoxy)benzamide Openeye Name: N-[(2-methoxy-5-nitro-phenyl)carbamothioyl]-4-(2-phenoxyethoxy)benzamide CAS Name: N-[(2-methoxy-5-nitroanilino)-sulfanylidenemethyl]-4-(2-phenoxyethoxy)benzamide IUPAC Name: N-[(2-methoxy-5-nitrophenyl)carbamothioyl]-4-(2-phenoxyethoxy)benzamide Traditional Name: N-[(2-methoxy-5-nitro-phenyl)thiocarbamoyl]-4-(2-phenoxyethoxy)benzamide Formula: C23H21N3O6S MolecularWeight: 467.49434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=S)NC(=O)C2=CC=C(C=C2)OCCOC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=S)NC(=O)C2=CC=C(C=C2)OCCOC3=CC=CC=C3

InChI

InChI=1S/C23H21N3O6S/c1-30-21-12-9-17(26(28)29)15-20(21)24-23(33)25-22(27)16-7-10-19(11-8-16)32-14-13-31-18-5-3-2-4-6-18/h2-12,15H,13-14H2,1H3,(H2,24,25,27,33)