calcium N-[2-[[4-oxidanyl-1,1-bis(oxidanylidene)thiolan-3-yl]amino]ethyl]carbamodithioate

Systemtic Name: calcium N-[2-[[4-oxidanyl-1,1-bis(oxidanylidene)thiolan-3-yl]amino]ethyl]carbamodithioate Openeye Name: calcium N-[2-[(4-hydroxy-1,1-dioxo-thiolan-3-yl)amino]ethyl]carbamodithioate CAS Name: calcium N-[2-[(4-hydroxy-1,1-dioxo-3-thiolanyl)amino]ethyl]carbamodithioate IUPAC Name: calcium N-[2-[(4-hydroxy-1,1-dioxothiolan-3-yl)amino]ethyl]carbamodithioate Traditional Name: calcium N-[2-[(4-hydroxy-1,1-diketo-thiolan-3-yl)amino]ethyl]carbamodithioate Formula: C14H26CaN4O6S6 MolecularWeight: 578.84744

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CS1(=O)=O)O)NCCNC(=S)[S-].C1C(C(CS1(=O)=O)O)NCCNC(=S)[S-].[Ca+2]

Isomeric SMILES

C1C(C(CS1(=O)=O)O)NCCNC(=S)[S-].C1C(C(CS1(=O)=O)O)NCCNC(=S)[S-].[Ca+2]

InChI

InChI=1S/2C7H14N2O3S3.Ca/c2*10-6-4-15(11,12)3-5(6)8-1-2-9-7(13)14;/h2*5-6,8,10H,1-4H2,(H2,9,13,14);/q;;+2/p-2