5-[1-(1H-indol-3-yl)but-3-enylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[1-(1H-indol-3-yl)but-3-enylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[1-(1H-indol-3-yl)but-3-enylidene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[1-(1H-indol-3-yl)but-3-enylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[1-(1H-indol-3-yl)but-3-enylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[1-(1H-indol-3-yl)but-3-enylidene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C16H13N3O2S MolecularWeight: 311.35832

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(=C1C(=O)NC(=S)NC1=O)C2=CNC3=CC=CC=C32

Isomeric SMILES

C=CCC(=C1C(=O)NC(=S)NC1=O)C2=CNC3=CC=CC=C32

InChI

InChI=1S/C16H13N3O2S/c1-2-5-10(13-14(20)18-16(22)19-15(13)21)11-8-17-12-7-4-3-6-9(11)12/h2-4,6-8,17H,1,5H2,(H2,18,19,20,21,22)