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

Systemtic Name: 1-butan-2-yl-5-[(2-methyl-5-nitro-1H-indol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(2-methyl-5-nitro-1H-indol-3-yl)methylene]-1-sec-butyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-butan-2-yl-5-[(2-methyl-5-nitro-1H-indol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-butan-2-yl-5-[(2-methyl-5-nitro-1H-indol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(2-methyl-5-nitro-1H-indol-3-yl)methylene]-1-sec-butyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C(=CC2=C(NC3=C2C=C(C=C3)[N+](=O)[O-])C)C(=O)NC1=S

Isomeric SMILES

CCC(C)N1C(=O)C(=CC2=C(NC3=C2C=C(C=C3)[N+](=O)[O-])C)C(=O)NC1=S

InChI

InChI=1S/C18H18N4O4S/c1-4-9(2)21-17(24)14(16(23)20-18(21)27)8-12-10(3)19-15-6-5-11(22(25)26)7-13(12)15/h5-9,19H,4H2,1-3H3,(H,20,23,27)