1-butan-2-yl-5-[(2-phenyl-1H-indol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-butan-2-yl-5-[(2-phenyl-1H-indol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(2-phenyl-1H-indol-3-yl)methylene]-1-sec-butyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-butan-2-yl-5-[(2-phenyl-1H-indol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-butan-2-yl-5-[(2-phenyl-1H-indol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(2-phenyl-1H-indol-3-yl)methylene]-1-sec-butyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C(=CC2=C(NC3=CC=CC=C32)C4=CC=CC=C4)C(=O)NC1=S

Isomeric SMILES

CCC(C)N1C(=O)C(=CC2=C(NC3=CC=CC=C32)C4=CC=CC=C4)C(=O)NC1=S

InChI

InChI=1S/C23H21N3O2S/c1-3-14(2)26-22(28)18(21(27)25-23(26)29)13-17-16-11-7-8-12-19(16)24-20(17)15-9-5-4-6-10-15/h4-14,24H,3H2,1-2H3,(H,25,27,29)