3-nitro-4-[2-oxidanylidene-2-[(3-pyrazin-2-yloxyphenyl)amino]ethyl]sulfanyl-benzamide

Systemtic Name: 3-nitro-4-[2-oxidanylidene-2-[(3-pyrazin-2-yloxyphenyl)amino]ethyl]sulfanyl-benzamide Openeye Name: 3-nitro-4-[2-oxo-2-(3-pyrazin-2-yloxyanilino)ethyl]sulfanyl-benzamide CAS Name: 3-nitro-4-[[2-oxo-2-[3-(2-pyrazinyloxy)anilino]ethyl]thio]benzamide IUPAC Name: 3-nitro-4-[2-oxo-2-(3-pyrazin-2-yloxyanilino)ethyl]sulfanylbenzamide Traditional Name: 4-[[2-keto-2-(3-pyrazin-2-yloxyanilino)ethyl]thio]-3-nitro-benzamide Formula: C19H15N5O5S MolecularWeight: 425.4179

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=NC=CN=C2)NC(=O)CSC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)OC2=NC=CN=C2)NC(=O)CSC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C19H15N5O5S/c20-19(26)12-4-5-16(15(8-12)24(27)28)30-11-17(25)23-13-2-1-3-14(9-13)29-18-10-21-6-7-22-18/h1-10H,11H2,(H2,20,26)(H,23,25)