1-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]thiourea

Systemtic Name: 1-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]thiourea Openeye Name: [2-(1,3-dioxoisoindolin-2-yl)propanoylamino]thiourea CAS Name: [[2-(1,3-dioxo-2-isoindolyl)-1-oxopropyl]amino]thiourea IUPAC Name: [2-(1,3-dioxoisoindol-2-yl)propanoylamino]thiourea Traditional Name: (2-phthalimidopropanoylamino)thiourea Formula: C12H12N4O3S MolecularWeight: 292.31368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC(=S)N)N1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CC(C(=O)NNC(=S)N)N1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C12H12N4O3S/c1-6(9(17)14-15-12(13)20)16-10(18)7-4-2-3-5-8(7)11(16)19/h2-6H,1H3,(H,14,17)(H3,13,15,20)