N-methyl-3-nitro-4-[(3-pyrazin-2-yloxyphenyl)amino]benzenesulfonamide

Systemtic Name: N-methyl-3-nitro-4-[(3-pyrazin-2-yloxyphenyl)amino]benzenesulfonamide Openeye Name: N-methyl-3-nitro-4-(3-pyrazin-2-yloxyanilino)benzenesulfonamide CAS Name: N-methyl-3-nitro-4-[3-(2-pyrazinyloxy)anilino]benzenesulfonamide IUPAC Name: N-methyl-3-nitro-4-(3-pyrazin-2-yloxyanilino)benzenesulfonamide Traditional Name: N-methyl-3-nitro-4-(3-pyrazin-2-yloxyanilino)benzenesulfonamide Formula: C17H15N5O5S MolecularWeight: 401.3965

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)NC2=CC(=CC=C2)OC3=NC=CN=C3)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)NC2=CC(=CC=C2)OC3=NC=CN=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N5O5S/c1-18-28(25,26)14-5-6-15(16(10-14)22(23)24)21-12-3-2-4-13(9-12)27-17-11-19-7-8-20-17/h2-11,18,21H,1H3