5-(1-ethanoylindol-3-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-(1-ethanoylindol-3-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-(1-acetylindol-3-yl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-(1-acetyl-3-indolyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-(1-acetylindol-3-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(1-acetylindol-3-yl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C14H11N3O3S MolecularWeight: 301.32044

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=C(C2=CC=CC=C21)C3C(=O)NC(=S)NC3=O

Isomeric SMILES

CC(=O)N1C=C(C2=CC=CC=C21)C3C(=O)NC(=S)NC3=O

InChI

InChI=1S/C14H11N3O3S/c1-7(18)17-6-9(8-4-2-3-5-10(8)17)11-12(19)15-14(21)16-13(11)20/h2-6,11H,1H3,(H2,15,16,19,20,21)