N-[2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethyl]benzenesulfonamide

Systemtic Name: N-[2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethyl]benzenesulfonamide Openeye Name: N-[2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]ethyl]benzenesulfonamide CAS Name: N-[2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]ethyl]benzenesulfonamide IUPAC Name: N-[2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]ethyl]benzenesulfonamide Traditional Name: N-[2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]ethyl]benzenesulfonamide Formula: C12H14N4O3S2 MolecularWeight: 326.39456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NCCSC2=NC(=O)C=C(N2)N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NCCSC2=NC(=O)C=C(N2)N

InChI

InChI=1S/C12H14N4O3S2/c13-10-8-11(17)16-12(15-10)20-7-6-14-21(18,19)9-4-2-1-3-5-9/h1-5,8,14H,6-7H2,(H3,13,15,16,17)