1-[[(5E)-5-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazol-3-yl]carbonylamino]thiourea

Systemtic Name: 1-[[(5E)-5-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazol-3-yl]carbonylamino]thiourea Openeye Name: [[(5E)-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carbonyl]amino]thiourea CAS Name: [[oxo-[(5E)-5-(6-oxo-1-cyclohexa-2,4-dienylidene)-1,2-dihydropyrazol-3-yl]methyl]amino]thiourea IUPAC Name: [[(5E)-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carbonyl]amino]thiourea Traditional Name: [[(5E)-5-(6-ketocyclohexa-2,4-dien-1-ylidene)-3-pyrazoline-3-carbonyl]amino]thiourea Formula: C11H11N5O2S MolecularWeight: 277.30234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=C(NN2)C(=O)NNC(=S)N)C(=O)C=C1

Isomeric SMILES

C1=C/C(=C\2/C=C(NN2)C(=O)NNC(=S)N)/C(=O)C=C1

InChI

InChI=1S/C11H11N5O2S/c12-11(19)16-15-10(18)8-5-7(13-14-8)6-3-1-2-4-9(6)17/h1-5,13-14H,(H,15,18)(H3,12,16,19)/b7-6+