3-[(4-nitrophenyl)methyl]-2-sulfanylidene-imidazolidin-4-one

Systemtic Name: 3-[(4-nitrophenyl)methyl]-2-sulfanylidene-imidazolidin-4-one Openeye Name: 3-[(4-nitrophenyl)methyl]-2-thioxo-imidazolidin-4-one CAS Name: 3-[(4-nitrophenyl)methyl]-2-sulfanylidene-4-imidazolidinone IUPAC Name: 3-[(4-nitrophenyl)methyl]-2-sulfanylideneimidazolidin-4-one Traditional Name: 3-(4-nitrobenzyl)-2-thioxo-4-imidazolidinone Formula: C10H9N3O3S MolecularWeight: 251.26176

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C(=S)N1)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1C(=O)N(C(=S)N1)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C10H9N3O3S/c14-9-5-11-10(17)12(9)6-7-1-3-8(4-2-7)13(15)16/h1-4H,5-6H2,(H,11,17)