5-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[4-[(E)-styryl]sulfonylpiperazin-1-yl]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-[[4-[(E)-styryl]sulfonylpiperazino]methylene]barbituric acid Formula: C17H18N4O5S MolecularWeight: 390.41362

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=C2C(=O)NC(=O)NC2=O)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C=C2C(=O)NC(=O)NC2=O)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C17H18N4O5S/c22-15-14(16(23)19-17(24)18-15)12-20-7-9-21(10-8-20)27(25,26)11-6-13-4-2-1-3-5-13/h1-6,11-12H,7-10H2,(H2,18,19,22,23,24)/b11-6+