N-(3-chloranyl-4-methoxy-phenyl)-2-(5-nitropyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-2-(5-nitropyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-2-[(5-nitro-2-pyridyl)sulfanyl]acetamide CAS Name: N-(3-chloro-4-methoxyphenyl)-2-[(5-nitro-2-pyridinyl)thio]acetamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-2-(5-nitropyridin-2-yl)sulfanylacetamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-2-[(5-nitro-2-pyridyl)thio]acetamide Formula: C14H12ClN3O4S MolecularWeight: 353.78078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CSC2=NC=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CSC2=NC=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H12ClN3O4S/c1-22-12-4-2-9(6-11(12)15)17-13(19)8-23-14-5-3-10(7-16-14)18(20)21/h2-7H,8H2,1H3,(H,17,19)