6-methyl-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]pyridine-3-carboxamide

Systemtic Name: 6-methyl-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]pyridine-3-carboxamide Openeye Name: 6-methyl-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]pyridine-3-carboxamide CAS Name: 6-methyl-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-3-pyridinecarboxamide IUPAC Name: 6-methyl-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]pyridine-3-carboxamide Traditional Name: N-[2-(4-mesyl-2-nitro-anilino)ethyl]-6-methyl-nicotinamide Formula: C16H18N4O5S MolecularWeight: 378.40292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C(=O)NCCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(C=C1)C(=O)NCCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O5S/c1-11-3-4-12(10-19-11)16(21)18-8-7-17-14-6-5-13(26(2,24)25)9-15(14)20(22)23/h3-6,9-10,17H,7-8H2,1-2H3,(H,18,21)