5-(5-bromanyl-1-methyl-2-oxidanylidene-indol-3-ylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-(5-bromanyl-1-methyl-2-oxidanylidene-indol-3-ylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-(5-bromo-1-methyl-2-oxo-indolin-3-ylidene)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-(5-bromo-1-methyl-2-oxo-3-indolylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-(5-bromo-1-methyl-2-oxoindol-3-ylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(5-bromo-2-keto-1-methyl-indolin-3-ylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C13H8BrN3O3S MolecularWeight: 366.18992

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)Br)C(=C3C(=O)NC(=S)NC3=O)C1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)Br)C(=C3C(=O)NC(=S)NC3=O)C1=O

InChI

InChI=1S/C13H8BrN3O3S/c1-17-7-3-2-5(14)4-6(7)8(12(17)20)9-10(18)15-13(21)16-11(9)19/h2-4H,1H3,(H2,15,16,18,19,21)