5-[(3-nitro-4-oxidanyl-phenyl)methyl]-3-phenyl-2-sulfanylidene-imidazolidin-4-one

Systemtic Name: 5-[(3-nitro-4-oxidanyl-phenyl)methyl]-3-phenyl-2-sulfanylidene-imidazolidin-4-one Openeye Name: 5-[(4-hydroxy-3-nitro-phenyl)methyl]-3-phenyl-2-thioxo-imidazolidin-4-one CAS Name: 5-[(4-hydroxy-3-nitrophenyl)methyl]-3-phenyl-2-sulfanylidene-4-imidazolidinone IUPAC Name: 5-[(4-hydroxy-3-nitrophenyl)methyl]-3-phenyl-2-sulfanylideneimidazolidin-4-one Traditional Name: 5-(4-hydroxy-3-nitro-benzyl)-3-phenyl-2-thioxo-4-imidazolidinone Formula: C16H13N3O4S MolecularWeight: 343.35712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(NC2=S)CC3=CC(=C(C=C3)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(NC2=S)CC3=CC(=C(C=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O4S/c20-14-7-6-10(9-13(14)19(22)23)8-12-15(21)18(16(24)17-12)11-4-2-1-3-5-11/h1-7,9,12,20H,8H2,(H,17,24)