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

Systemtic Name: 5-[[(2-piperidin-1-yl-5-piperidin-1-ylsulfonyl-phenyl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[[2-(1-piperidyl)-5-(1-piperidylsulfonyl)anilino]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[2-(1-piperidinyl)-5-(1-piperidinylsulfonyl)anilino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(2-piperidin-1-yl-5-piperidin-1-ylsulfonylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(2-piperidino-5-piperidinosulfonyl-anilino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C21H27N5O4S2 MolecularWeight: 477.60018

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)NC=C4C(=O)NC(=S)NC4=O

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)NC=C4C(=O)NC(=S)NC4=O

InChI

InChI=1S/C21H27N5O4S2/c27-19-16(20(28)24-21(31)23-19)14-22-17-13-15(32(29,30)26-11-5-2-6-12-26)7-8-18(17)25-9-3-1-4-10-25/h7-8,13-14,22H,1-6,9-12H2,(H2,23,24,27,28,31)