N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-(3,4-dimethylphenyl)sulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-(3,4-dimethylphenyl)sulfanyl-pyridine-3-carboxamide Openeye Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-(3,4-dimethylphenyl)sulfanyl-pyridine-3-carboxamide CAS Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-2-[(3,4-dimethylphenyl)thio]-3-pyridinecarboxamide IUPAC Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-2-(3,4-dimethylphenyl)sulfanylpyridine-3-carboxamide Traditional Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-[(3,4-dimethylphenyl)thio]nicotinamide Formula: C24H25N3O5S MolecularWeight: 467.5374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)NCCC3=CC(=C(C=C3[N+](=O)[O-])OC)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)NCCC3=CC(=C(C=C3[N+](=O)[O-])OC)OC)C

InChI

InChI=1S/C24H25N3O5S/c1-15-7-8-18(12-16(15)2)33-24-19(6-5-10-26-24)23(28)25-11-9-17-13-21(31-3)22(32-4)14-20(17)27(29)30/h5-8,10,12-14H,9,11H2,1-4H3,(H,25,28)