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

Systemtic Name: 1-methyl-5-[[[4-(piperidin-1-ylmethyl)phenyl]amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-methyl-5-[[4-(1-piperidylmethyl)anilino]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-methyl-5-[[4-(1-piperidinylmethyl)anilino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-methyl-5-[[4-(piperidin-1-ylmethyl)anilino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-methyl-5-[[4-(piperidinomethyl)anilino]methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CNC2=CC=C(C=C2)CN3CCCCC3)C(=O)NC1=S

Isomeric SMILES

CN1C(=O)C(=CNC2=CC=C(C=C2)CN3CCCCC3)C(=O)NC1=S

InChI

InChI=1S/C18H22N4O2S/c1-21-17(24)15(16(23)20-18(21)25)11-19-14-7-5-13(6-8-14)12-22-9-3-2-4-10-22/h5-8,11,19H,2-4,9-10,12H2,1H3,(H,20,23,25)