5-[(2-piperidin-1-ylethylamino)methylidene]-1-(4-propan-2-ylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(2-piperidin-1-ylethylamino)methylidene]-1-(4-propan-2-ylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(4-isopropylphenyl)-5-[[2-(1-piperidyl)ethylamino]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[2-(1-piperidinyl)ethylamino]methylidene]-1-(4-propan-2-ylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(2-piperidin-1-ylethylamino)methylidene]-1-(4-propan-2-ylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-p-cumenyl-5-[(2-piperidinoethylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C21H28N4O2S MolecularWeight: 400.53762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=O)C(=CNCCN3CCCCC3)C(=O)NC2=S

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=O)C(=CNCCN3CCCCC3)C(=O)NC2=S

InChI

InChI=1S/C21H28N4O2S/c1-15(2)16-6-8-17(9-7-16)25-20(27)18(19(26)23-21(25)28)14-22-10-13-24-11-4-3-5-12-24/h6-9,14-15,22H,3-5,10-13H2,1-2H3,(H,23,26,28)