[3,4,5-triacetyloxy-6-[[(5-bromanyl-2-oxidanylidene-indol-3-yl)amino]carbamothioylamino]oxan-2-yl]methyl ethanoate

Systemtic Name: [3,4,5-triacetyloxy-6-[[(5-bromanyl-2-oxidanylidene-indol-3-yl)amino]carbamothioylamino]oxan-2-yl]methyl ethanoate Openeye Name: [3,4,5-triacetoxy-6-[[(5-bromo-2-oxo-indol-3-yl)amino]carbamothioylamino]tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [3,4,5-triacetyloxy-6-[[[(5-bromo-2-oxo-3-indolyl)hydrazo]-sulfanylidenemethyl]amino]-2-oxanyl]methyl ester IUPAC Name: [3,4,5-triacetyloxy-6-[[(5-bromo-2-oxoindol-3-yl)amino]carbamothioylamino]oxan-2-yl]methyl acetate Traditional Name: acetic acid [3,4,5-triacetoxy-6-[[(5-bromo-2-keto-indol-3-yl)amino]thiocarbamoylamino]tetrahydropyran-2-yl]methyl ester Formula: C23H25BrN4O10S MolecularWeight: 629.4344

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)NC(=S)NNC2=C3C=C(C=CC3=NC2=O)Br)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OCC1C(C(C(C(O1)NC(=S)NNC2=C3C=C(C=CC3=NC2=O)Br)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C23H25BrN4O10S/c1-9(29)34-8-16-18(35-10(2)30)19(36-11(3)31)20(37-12(4)32)22(38-16)26-23(39)28-27-17-14-7-13(24)5-6-15(14)25-21(17)33/h5-7,16,18-20,22H,8H2,1-4H3,(H,25,27,33)(H2,26,28,39)