2-[2-[(2-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanylpyrimidin-4-olate

Systemtic Name: 2-[2-[(2-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanylpyrimidin-4-olate Openeye Name: 2-[2-[(2-chlorophenyl)methylamino]-2-oxo-ethyl]sulfanylpyrimidin-4-olate CAS Name: 2-[[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]thio]-4-pyrimidinolate IUPAC Name: 2-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]sulfanylpyrimidin-4-olate Traditional Name: 2-[[2-[(2-chlorobenzyl)amino]-2-keto-ethyl]thio]pyrimidin-4-olate Formula: C13H11ClN3O2S- MolecularWeight: 308.76334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)CSC2=NC=CC(=N2)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)CSC2=NC=CC(=N2)[O-])Cl

InChI

InChI=1S/C13H12ClN3O2S/c14-10-4-2-1-3-9(10)7-16-12(19)8-20-13-15-6-5-11(18)17-13/h1-6H,7-8H2,(H,16,19)(H,15,17,18)/p-1