1-(3-nitrophenyl)-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(3-nitrophenyl)-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(3-nitrophenyl)-3-phenyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(3-nitrophenyl)-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(3-nitrophenyl)-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(3-nitrophenyl)-3-phenyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C16H11N3O4S MolecularWeight: 341.34124

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C(=S)N(C1=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C1C(=O)N(C(=S)N(C1=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C16H11N3O4S/c20-14-10-15(21)18(12-7-4-8-13(9-12)19(22)23)16(24)17(14)11-5-2-1-3-6-11/h1-9H,10H2