1-[(4-fluorophenyl)methyl]-5-[(3-piperidin-1-ylpropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-[(4-fluorophenyl)methyl]-5-[(3-piperidin-1-ylpropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-[(4-fluorophenyl)methyl]-5-[[3-(1-piperidyl)propylamino]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-[(4-fluorophenyl)methyl]-5-[[3-(1-piperidinyl)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-[(4-fluorophenyl)methyl]-5-[(3-piperidin-1-ylpropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(4-fluorobenzyl)-5-[(3-piperidinopropylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C20H25FN4O2S MolecularWeight: 404.501503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCNC=C2C(=O)NC(=S)N(C2=O)CC3=CC=C(C=C3)F

Isomeric SMILES

C1CCN(CC1)CCCNC=C2C(=O)NC(=S)N(C2=O)CC3=CC=C(C=C3)F

InChI

InChI=1S/C20H25FN4O2S/c21-16-7-5-15(6-8-16)14-25-19(27)17(18(26)23-20(25)28)13-22-9-4-12-24-10-2-1-3-11-24/h5-8,13,22H,1-4,9-12,14H2,(H,23,26,28)