3-azanyl-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]pyrazine-2-carboxamide

Systemtic Name: 3-azanyl-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]pyrazine-2-carboxamide Openeye Name: 3-amino-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]pyrazine-2-carboxamide CAS Name: 3-amino-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-2-pyrazinecarboxamide IUPAC Name: 3-amino-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]pyrazine-2-carboxamide Traditional Name: 3-amino-N-[2-(4-mesyl-2-nitro-anilino)ethyl]pyrazinamide Formula: C14H16N6O5S MolecularWeight: 380.37904

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)C2=NC=CN=C2N)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)C2=NC=CN=C2N)[N+](=O)[O-]

InChI

InChI=1S/C14H16N6O5S/c1-26(24,25)9-2-3-10(11(8-9)20(22)23)16-4-7-19-14(21)12-13(15)18-6-5-17-12/h2-3,5-6,8,16H,4,7H2,1H3,(H2,15,18)(H,19,21)