1-butyl-5-[(1-ethylindol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-butyl-5-[(1-ethylindol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-butyl-5-[(1-ethylindol-3-yl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-butyl-5-[(1-ethyl-3-indolyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-butyl-5-[(1-ethylindol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-butyl-5-[(1-ethylindol-3-yl)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=CC2=CN(C3=CC=CC=C32)CC)C(=O)NC1=S

Isomeric SMILES

CCCCN1C(=O)C(=CC2=CN(C3=CC=CC=C32)CC)C(=O)NC1=S

InChI

InChI=1S/C19H21N3O2S/c1-3-5-10-22-18(24)15(17(23)20-19(22)25)11-13-12-21(4-2)16-9-7-6-8-14(13)16/h6-9,11-12H,3-5,10H2,1-2H3,(H,20,23,25)