1-ethyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-ethyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-ethyl-5-[(2-piperazin-1-ylethylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-ethyl-5-[[2-(1-piperazinyl)ethylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-ethyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-ethyl-5-[(2-piperazinoethylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C13H21N5O2S MolecularWeight: 311.40314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CNCCN2CCNCC2)C(=O)NC1=S

Isomeric SMILES

CCN1C(=O)C(=CNCCN2CCNCC2)C(=O)NC1=S

InChI

InChI=1S/C13H21N5O2S/c1-2-18-12(20)10(11(19)16-13(18)21)9-15-5-8-17-6-3-14-4-7-17/h9,14-15H,2-8H2,1H3,(H,16,19,21)