(5E)-1-methyl-3-phenyl-5-[(piperidin-1-ylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5E)-1-methyl-3-phenyl-5-[(piperidin-1-ylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5E)-1-methyl-3-phenyl-5-[(1-piperidylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5E)-1-methyl-3-phenyl-5-[(1-piperidinylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5E)-1-methyl-3-phenyl-5-[(piperidin-1-ylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5E)-1-methyl-3-phenyl-5-[(piperidinoamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C17H20N4O2S MolecularWeight: 344.4313

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CNN2CCCCC2)C(=O)N(C1=S)C3=CC=CC=C3

Isomeric SMILES

CN1C(=O)/C(=C\NN2CCCCC2)/C(=O)N(C1=S)C3=CC=CC=C3

InChI

InChI=1S/C17H20N4O2S/c1-19-15(22)14(12-18-20-10-6-3-7-11-20)16(23)21(17(19)24)13-8-4-2-5-9-13/h2,4-5,8-9,12,18H,3,6-7,10-11H2,1H3/b14-12+