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

Systemtic Name: 5-[(1-butyl-2,3-dihydroindol-5-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(1-butylindolin-5-yl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(1-butyl-2,3-dihydroindol-5-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(1-butyl-2,3-dihydroindol-5-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(1-butylindolin-5-yl)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C17H19N3O2S MolecularWeight: 329.41666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC2=C1C=CC(=C2)C=C3C(=O)NC(=S)NC3=O

Isomeric SMILES

CCCCN1CCC2=C1C=CC(=C2)C=C3C(=O)NC(=S)NC3=O

InChI

InChI=1S/C17H19N3O2S/c1-2-3-7-20-8-6-12-9-11(4-5-14(12)20)10-13-15(21)18-17(23)19-16(13)22/h4-5,9-10H,2-3,6-8H2,1H3,(H2,18,19,21,22,23)