1-thia-4,7,10-triazacyclododecane-3,11-dione

Systemtic Name: 1-thia-4,7,10-triazacyclododecane-3,11-dione Openeye Name: 1-thia-4,7,10-triazacyclododecane-3,11-dione CAS Name: 1-thia-4,7,10-triazacyclododecane-3,11-dione IUPAC Name: 1-thia-4,7,10-triazacyclododecane-3,11-dione Traditional Name: 1-thia-4,7,10-triazacyclododecane-3,11-quinone Formula: C8H15N3O2S MolecularWeight: 217.2886

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=O)CSCC(=O)NCCN1

Isomeric SMILES

C1CNC(=O)CSCC(=O)NCCN1

InChI

InChI=1S/C8H15N3O2S/c12-7-5-14-6-8(13)11-4-2-9-1-3-10-7/h9H,1-6H2,(H,10,12)(H,11,13)