5-(2-bromanylprop-2-enoylamino)-N-[2-[[2-methyl-5-[(4-methylidene-5-oxidanylidene-2-phenyl-oxolan-2-yl)methoxy]pyrazol-3-yl]carbonylamino]ethyl]-1H-indole-2-carboxamide

Systemtic Name: 5-(2-bromanylprop-2-enoylamino)-N-[2-[[2-methyl-5-[(4-methylidene-5-oxidanylidene-2-phenyl-oxolan-2-yl)methoxy]pyrazol-3-yl]carbonylamino]ethyl]-1H-indole-2-carboxamide Openeye Name: 5-(2-bromoprop-2-enoylamino)-N-[2-[[2-methyl-5-[(4-methylene-5-oxo-2-phenyl-tetrahydrofuran-2-yl)methoxy]pyrazole-3-carbonyl]amino]ethyl]-1H-indole-2-carboxamide CAS Name: 5-[(2-bromo-1-oxoprop-2-enyl)amino]-N-[2-[[[2-methyl-5-[(4-methylene-5-oxo-2-phenyl-2-oxolanyl)methoxy]-3-pyrazolyl]-oxomethyl]amino]ethyl]-1H-indole-2-carboxamide IUPAC Name: 5-(2-bromoprop-2-enoylamino)-N-[2-[[2-methyl-5-[(4-methylidene-5-oxo-2-phenyloxolan-2-yl)methoxy]pyrazole-3-carbonyl]amino]ethyl]-1H-indole-2-carboxamide Traditional Name: 5-[(2-bromoacryloyl)amino]-N-[2-[[5-[(5-keto-4-methylene-2-phenyl-tetrahydrofuran-2-yl)methoxy]-2-methyl-pyrazole-3-carbonyl]amino]ethyl]-1H-indole-2-carboxamide Formula: C31H29BrN6O6 MolecularWeight: 661.50256

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)OCC2(CC(=C)C(=O)O2)C3=CC=CC=C3)C(=O)NCCNC(=O)C4=CC5=C(N4)C=CC(=C5)NC(=O)C(=C)Br

Isomeric SMILES

CN1C(=CC(=N1)OCC2(CC(=C)C(=O)O2)C3=CC=CC=C3)C(=O)NCCNC(=O)C4=CC5=C(N4)C=CC(=C5)NC(=O)C(=C)Br

InChI

InChI=1S/C31H29BrN6O6/c1-18-16-31(44-30(18)42,21-7-5-4-6-8-21)17-43-26-15-25(38(3)37-26)29(41)34-12-11-33-28(40)24-14-20-13-22(9-10-23(20)36-24)35-27(39)19(2)32/h4-10,13-15,36H,1-2,11-12,16-17H2,3H3,(H,33,40)(H,34,41)(H,35,39)