4-[2-[3,5-bis(oxidanylidene)piperazin-1-yl]propyl]-1-(thiomorpholin-4-ylmethyl)piperazine-2,6-dione

Systemtic Name: 4-[2-[3,5-bis(oxidanylidene)piperazin-1-yl]propyl]-1-(thiomorpholin-4-ylmethyl)piperazine-2,6-dione Openeye Name: 4-[2-(3,5-dioxopiperazin-1-yl)propyl]-1-(thiomorpholinomethyl)piperazine-2,6-dione CAS Name: 4-[2-(3,5-dioxo-1-piperazinyl)propyl]-1-(thiomorpholin-4-ylmethyl)piperazine-2,6-dione IUPAC Name: 4-[2-(3,5-dioxopiperazin-1-yl)propyl]-1-(thiomorpholin-4-ylmethyl)piperazine-2,6-dione Traditional Name: 4-[2-(3,5-diketopiperazino)propyl]-1-(thiomorpholinomethyl)piperazine-2,6-quinone Formula: C16H25N5O4S MolecularWeight: 383.4658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CC(=O)N(C(=O)C1)CN2CCSCC2)N3CC(=O)NC(=O)C3

Isomeric SMILES

CC(CN1CC(=O)N(C(=O)C1)CN2CCSCC2)N3CC(=O)NC(=O)C3

InChI

InChI=1S/C16H25N5O4S/c1-12(20-7-13(22)17-14(23)8-20)6-19-9-15(24)21(16(25)10-19)11-18-2-4-26-5-3-18/h12H,2-11H2,1H3,(H,17,22,23)