[2-chloranyl-4-[(3-nitropyridin-2-yl)amino]sulfanyl-phenyl]-(2-methylphenyl)methanone

Systemtic Name: [2-chloranyl-4-[(3-nitropyridin-2-yl)amino]sulfanyl-phenyl]-(2-methylphenyl)methanone Openeye Name: [2-chloro-4-[(3-nitro-2-pyridyl)amino]sulfanyl-phenyl]-(o-tolyl)methanone CAS Name: 3-chloro-4-[(2-methylphenyl)-oxomethyl]-N-(3-nitro-2-pyridinyl)benzenesulfenamide IUPAC Name: [2-chloro-4-[(3-nitropyridin-2-yl)amino]sulfanylphenyl]-(2-methylphenyl)methanone Traditional Name: [2-chloro-4-[[(3-nitro-2-pyridyl)amino]thio]phenyl]-(o-tolyl)methanone Formula: C19H14ClN3O3S MolecularWeight: 399.85076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C2=C(C=C(C=C2)SNC3=C(C=CC=N3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)C2=C(C=C(C=C2)SNC3=C(C=CC=N3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H14ClN3O3S/c1-12-5-2-3-6-14(12)18(24)15-9-8-13(11-16(15)20)27-22-19-17(23(25)26)7-4-10-21-19/h2-11H,1H3,(H,21,22)