5-[[(2-chloranyl-5-nitro-phenyl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[[(2-chloranyl-5-nitro-phenyl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(2-chloro-5-nitro-anilino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(2-chloro-5-nitroanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(2-chloro-5-nitroanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(2-chloro-5-nitro-anilino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C11H7ClN4O4S MolecularWeight: 326.71568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])NC=C2C(=O)NC(=S)NC2=O)Cl

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])NC=C2C(=O)NC(=S)NC2=O)Cl

InChI

InChI=1S/C11H7ClN4O4S/c12-7-2-1-5(16(19)20)3-8(7)13-4-6-9(17)14-11(21)15-10(6)18/h1-4,13H,(H2,14,15,17,18,21)