3,5-bis(chloranyl)-2-methoxy-N-[(2-methyl-5-nitro-phenyl)carbamothioyl]benzamide

Systemtic Name: 3,5-bis(chloranyl)-2-methoxy-N-[(2-methyl-5-nitro-phenyl)carbamothioyl]benzamide Openeye Name: 3,5-dichloro-2-methoxy-N-[(2-methyl-5-nitro-phenyl)carbamothioyl]benzamide CAS Name: 3,5-dichloro-2-methoxy-N-[(2-methyl-5-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3,5-dichloro-2-methoxy-N-[(2-methyl-5-nitrophenyl)carbamothioyl]benzamide Traditional Name: 3,5-dichloro-2-methoxy-N-[(2-methyl-5-nitro-phenyl)thiocarbamoyl]benzamide Formula: C16H13Cl2N3O4S MolecularWeight: 414.26312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=S)NC(=O)C2=CC(=CC(=C2OC)Cl)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=S)NC(=O)C2=CC(=CC(=C2OC)Cl)Cl

InChI

InChI=1S/C16H13Cl2N3O4S/c1-8-3-4-10(21(23)24)7-13(8)19-16(26)20-15(22)11-5-9(17)6-12(18)14(11)25-2/h3-7H,1-2H3,(H2,19,20,22,26)