N-[4-(4-nitrophenyl)sulfanylphenyl]pyrazine-2-carboxamide

Systemtic Name: N-[4-(4-nitrophenyl)sulfanylphenyl]pyrazine-2-carboxamide Openeye Name: N-[4-(4-nitrophenyl)sulfanylphenyl]pyrazine-2-carboxamide CAS Name: N-[4-[(4-nitrophenyl)thio]phenyl]-2-pyrazinecarboxamide IUPAC Name: N-[4-(4-nitrophenyl)sulfanylphenyl]pyrazine-2-carboxamide Traditional Name: N-[4-[(4-nitrophenyl)thio]phenyl]pyrazinamide Formula: C17H12N4O3S MolecularWeight: 352.36718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C2=NC=CN=C2)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C2=NC=CN=C2)SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H12N4O3S/c22-17(16-11-18-9-10-19-16)20-12-1-5-14(6-2-12)25-15-7-3-13(4-8-15)21(23)24/h1-11H,(H,20,22)