1-[(E)-1-(4-nitrophenyl)ethylideneamino]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-[(E)-1-(4-nitrophenyl)ethylideneamino]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-[(E)-1-(4-nitrophenyl)ethylideneamino]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-[(E)-1-(4-nitrophenyl)ethylideneamino]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-[(E)-1-(4-nitrophenyl)ethylideneamino]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-[(E)-1-(4-nitrophenyl)ethylideneamino]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C12H10N4O4S MolecularWeight: 306.2972

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NN1C(=O)CC(=O)NC1=S)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C/C(=N\N1C(=O)CC(=O)NC1=S)/C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H10N4O4S/c1-7(8-2-4-9(5-3-8)16(19)20)14-15-11(18)6-10(17)13-12(15)21/h2-5H,6H2,1H3,(H,13,17,21)/b14-7+