(5E)-1-phenyl-5-[[(2-pyridin-3-ylpiperidin-1-yl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5E)-1-phenyl-5-[[(2-pyridin-3-ylpiperidin-1-yl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5E)-1-phenyl-5-[[[2-(3-pyridyl)-1-piperidyl]amino]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5E)-1-phenyl-5-[[[2-(3-pyridinyl)-1-piperidinyl]amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5E)-1-phenyl-5-[[(2-pyridin-3-ylpiperidin-1-yl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5E)-1-phenyl-5-[[[2-(3-pyridyl)piperidino]amino]methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C21H21N5O2S MolecularWeight: 407.48874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=CN=CC=C2)NC=C3C(=O)NC(=S)N(C3=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C(C1)C2=CN=CC=C2)N/C=C/3\C(=O)NC(=S)N(C3=O)C4=CC=CC=C4

InChI

InChI=1S/C21H21N5O2S/c27-19-17(20(28)26(21(29)24-19)16-8-2-1-3-9-16)14-23-25-12-5-4-10-18(25)15-7-6-11-22-13-15/h1-3,6-9,11,13-14,18,23H,4-5,10,12H2,(H,24,27,29)/b17-14+