1-(2-nitrophenyl)-3-[(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]thiourea

Systemtic Name: 1-(2-nitrophenyl)-3-[(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]thiourea Openeye Name: 1-[(2-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-(2-nitrophenyl)thiourea CAS Name: 1-[(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-(2-nitrophenyl)thiourea IUPAC Name: 1-[(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-(2-nitrophenyl)thiourea Traditional Name: 1-[(2-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-(2-nitrophenyl)thiourea Formula: C14H12N4O4S MolecularWeight: 332.33448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=S)NNC=C2C=CC(=O)C=C2O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)NC(=S)NNC=C2C=CC(=O)C=C2O)[N+](=O)[O-]

InChI

InChI=1S/C14H12N4O4S/c19-10-6-5-9(13(20)7-10)8-15-17-14(23)16-11-3-1-2-4-12(11)18(21)22/h1-8,15,20H,(H2,16,17,23)