5-carboxy-6-oxidanylidene-2-[[4-(sulfinatoamino)phenyl]methylamino]-1H-pyrimidine

Systemtic Name: 5-carboxy-6-oxidanylidene-2-[[4-(sulfinatoamino)phenyl]methylamino]-1H-pyrimidine Openeye Name: 5-carboxy-6-oxo-2-[[4-(sulfinatoamino)phenyl]methylamino]-1H-pyrimidine CAS Name: 5-carboxy-6-oxo-2-[[4-(sulfinatoamino)phenyl]methylamino]-1H-pyrimidine IUPAC Name: 5-carboxy-6-oxo-2-[[4-(sulfinatoamino)phenyl]methylamino]-1H-pyrimidine Traditional Name: 5-carboxy-6-keto-2-[[4-(sulfinatoamino)benzyl]amino]-1H-pyrimidine Formula: C12H11N4O5S- MolecularWeight: 323.30454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=NC=C(C(=O)N2)C(=O)O)NS(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CNC2=NC=C(C(=O)N2)C(=O)O)NS(=O)[O-]

InChI

InChI=1S/C12H12N4O5S/c17-10-9(11(18)19)6-14-12(15-10)13-5-7-1-3-8(4-2-7)16-22(20)21/h1-4,6,16H,5H2,(H,18,19)(H,20,21)(H2,13,14,15,17)/p-1