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

Systemtic Name: 1-butan-2-yl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(2-piperazin-1-ylethylamino)methylene]-1-sec-butyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-butan-2-yl-5-[[2-(1-piperazinyl)ethylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-butan-2-yl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(2-piperazinoethylamino)methylene]-1-sec-butyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C15H25N5O2S MolecularWeight: 339.4563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C(=CNCCN2CCNCC2)C(=O)NC1=S

Isomeric SMILES

CCC(C)N1C(=O)C(=CNCCN2CCNCC2)C(=O)NC1=S

InChI

InChI=1S/C15H25N5O2S/c1-3-11(2)20-14(22)12(13(21)18-15(20)23)10-17-6-9-19-7-4-16-5-8-19/h10-11,16-17H,3-9H2,1-2H3,(H,18,21,23)