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

Systemtic Name: 5-[(azepan-1-ylamino)methylidene]-1-butan-2-yl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(azepan-1-ylamino)methylene]-1-sec-butyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(1-azepanylamino)methylidene]-1-butan-2-yl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(azepan-1-ylamino)methylidene]-1-butan-2-yl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(azepan-1-ylamino)methylene]-1-sec-butyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C15H24N4O2S MolecularWeight: 324.44166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C(=CNN2CCCCCC2)C(=O)NC1=S

Isomeric SMILES

CCC(C)N1C(=O)C(=CNN2CCCCCC2)C(=O)NC1=S

InChI

InChI=1S/C15H24N4O2S/c1-3-11(2)19-14(21)12(13(20)17-15(19)22)10-16-18-8-6-4-5-7-9-18/h10-11,16H,3-9H2,1-2H3,(H,17,20,22)