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

Systemtic Name: 1-(2-methoxyethyl)-3-[(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]thiourea Openeye Name: 1-(2-methoxyethyl)-3-[(3-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]thiourea CAS Name: 1-(2-methoxyethyl)-3-[(3-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]thiourea IUPAC Name: 1-(2-methoxyethyl)-3-[(3-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]thiourea Traditional Name: 1-[(4-keto-3-nitro-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-(2-methoxyethyl)thiourea Formula: C11H14N4O4S MolecularWeight: 298.31826

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=S)NNC=C1C=CC(=O)C(=C1)[N+](=O)[O-]

Isomeric SMILES

COCCNC(=S)NNC=C1C=CC(=O)C(=C1)[N+](=O)[O-]

InChI

InChI=1S/C11H14N4O4S/c1-19-5-4-12-11(20)14-13-7-8-2-3-10(16)9(6-8)15(17)18/h2-3,6-7,13H,4-5H2,1H3,(H2,12,14,20)