N3-[(ethanethioylamino)methyl]-N1-ethyl-N5-methyl-1,3,5-triazinane-1,3,5-tricarbothioamide

Systemtic Name: N3-[(ethanethioylamino)methyl]-N1-ethyl-N5-methyl-1,3,5-triazinane-1,3,5-tricarbothioamide Openeye Name: N3-[(ethanethioylamino)methyl]-N1-ethyl-N5-methyl-1,3,5-triazinane-1,3,5-tricarbothioamide CAS Name: N1-ethyl-N5-methyl-N3-[(1-sulfanylideneethylamino)methyl]-1,3,5-triazinane-1,3,5-tricarbothioamide IUPAC Name: 3-N-[(ethanethioylamino)methyl]-1-N-ethyl-5-N-methyl-1,3,5-triazinane-1,3,5-tricarbothioamide Traditional Name: N1-ethyl-N5-methyl-N3-[(thioacetylamino)methyl]-1,3,5-triazinane-1,3,5-tricarbothioamide Formula: C12H23N7S4 MolecularWeight: 393.61792

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N1CN(CN(C1)C(=S)NCNC(=S)C)C(=S)NC

Isomeric SMILES

CCNC(=S)N1CN(CN(C1)C(=S)NCNC(=S)C)C(=S)NC

InChI

InChI=1S/C12H23N7S4/c1-4-14-11(22)18-6-17(10(21)13-3)7-19(8-18)12(23)16-5-15-9(2)20/h4-8H2,1-3H3,(H,13,21)(H,14,22)(H,15,20)(H,16,23)