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

Systemtic Name: 5-[(5-bromanyl-2-methyl-1H-indol-3-yl)methylidene]-1-butan-2-yl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(5-bromo-2-methyl-1H-indol-3-yl)methylene]-1-sec-butyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(5-bromo-2-methyl-1H-indol-3-yl)methylidene]-1-butan-2-yl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(5-bromo-2-methyl-1H-indol-3-yl)methylidene]-1-butan-2-yl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(5-bromo-2-methyl-1H-indol-3-yl)methylene]-1-sec-butyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C18H18BrN3O2S MolecularWeight: 420.32342

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C(=CC2=C(NC3=C2C=C(C=C3)Br)C)C(=O)NC1=S

Isomeric SMILES

CCC(C)N1C(=O)C(=CC2=C(NC3=C2C=C(C=C3)Br)C)C(=O)NC1=S

InChI

InChI=1S/C18H18BrN3O2S/c1-4-9(2)22-17(24)14(16(23)21-18(22)25)8-12-10(3)20-15-6-5-11(19)7-13(12)15/h5-9,20H,4H2,1-3H3,(H,21,23,25)