2-[2-(phenylsulfonyl)-4-(sulfinatoamino)phenyl]pyrimidine

Systemtic Name: 2-[2-(phenylsulfonyl)-4-(sulfinatoamino)phenyl]pyrimidine Openeye Name: 2-[2-(benzenesulfonyl)-4-(sulfinatoamino)phenyl]pyrimidine CAS Name: 2-[2-(benzenesulfonyl)-4-(sulfinatoamino)phenyl]pyrimidine IUPAC Name: 2-[2-(benzenesulfonyl)-4-(sulfinatoamino)phenyl]pyrimidine Traditional Name: 2-[2-besyl-4-(sulfinatoamino)phenyl]pyrimidine Formula: C16H12N3O4S2- MolecularWeight: 374.41418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C2=C(C=CC(=C2)NS(=O)[O-])C3=NC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C2=C(C=CC(=C2)NS(=O)[O-])C3=NC=CC=N3

InChI

InChI=1S/C16H13N3O4S2/c20-24(21)19-12-7-8-14(16-17-9-4-10-18-16)15(11-12)25(22,23)13-5-2-1-3-6-13/h1-11,19H,(H,20,21)/p-1