5-[1-ethanoyl-5-(3-nitrophenyl)pyrazolidin-3-ylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[1-ethanoyl-5-(3-nitrophenyl)pyrazolidin-3-ylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[1-acetyl-5-(3-nitrophenyl)pyrazolidin-3-ylidene]-1,3-dimethyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[1-acetyl-5-(3-nitrophenyl)-3-pyrazolidinylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[1-acetyl-5-(3-nitrophenyl)pyrazolidin-3-ylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[1-acetyl-5-(3-nitrophenyl)pyrazolidin-3-ylidene]-1,3-dimethyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C17H17N5O5S MolecularWeight: 403.41238

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CC(=C2C(=O)N(C(=S)N(C2=O)C)C)N1)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1C(CC(=C2C(=O)N(C(=S)N(C2=O)C)C)N1)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O5S/c1-9(23)21-13(10-5-4-6-11(7-10)22(26)27)8-12(18-21)14-15(24)19(2)17(28)20(3)16(14)25/h4-7,13,18H,8H2,1-3H3