6-[(4Z)-4-(5-bromanyl-2-oxidanylidene-1H-indol-3-ylidene)-5-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl]hexanoate

Systemtic Name: 6-[(4Z)-4-(5-bromanyl-2-oxidanylidene-1H-indol-3-ylidene)-5-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl]hexanoate Openeye Name: 6-[(4Z)-4-(5-bromo-2-oxo-indolin-3-ylidene)-5-oxo-2-thioxo-imidazolidin-1-yl]hexanoate CAS Name: 6-[(4Z)-4-(5-bromo-2-oxo-1H-indol-3-ylidene)-5-oxo-2-sulfanylidene-1-imidazolidinyl]hexanoate IUPAC Name: 6-[(4Z)-4-(5-bromo-2-oxo-1H-indol-3-ylidene)-5-oxo-2-sulfanylideneimidazolidin-1-yl]hexanoate Traditional Name: 6-[(4Z)-4-(5-bromo-2-keto-indolin-3-ylidene)-5-keto-2-thioxo-imidazolidin-1-yl]hexanoate Formula: C17H15BrN3O4S- MolecularWeight: 437.2877

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)C(=C3C(=O)N(C(=S)N3)CCCCCC(=O)[O-])C(=O)N2

Isomeric SMILES

C1=CC2=C(C=C1Br)/C(=C/3\C(=O)N(C(=S)N3)CCCCCC(=O)[O-])/C(=O)N2

InChI

InChI=1S/C17H16BrN3O4S/c18-9-5-6-11-10(8-9)13(15(24)19-11)14-16(25)21(17(26)20-14)7-3-1-2-4-12(22)23/h5-6,8H,1-4,7H2,(H,19,24)(H,20,26)(H,22,23)/p-1/b14-13-