5-bromanyl-N'-[[2-[(2S)-butan-2-yl]indol-3-ylidene]methyl]-1-benzofuran-2-carbohydrazide

Systemtic Name: 5-bromanyl-N'-[[2-[(2S)-butan-2-yl]indol-3-ylidene]methyl]-1-benzofuran-2-carbohydrazide Openeye Name: 5-bromo-N'-[[2-[(1S)-1-methylpropyl]indol-3-ylidene]methyl]benzofuran-2-carbohydrazide CAS Name: 5-bromo-N'-[[2-[(2S)-butan-2-yl]-3-indolylidene]methyl]-2-benzofurancarbohydrazide IUPAC Name: 5-bromo-N'-[[2-[(2S)-butan-2-yl]indol-3-ylidene]methyl]-1-benzofuran-2-carbohydrazide Traditional Name: 5-bromo-N'-[[2-[(1S)-1-methylpropyl]indol-3-ylidene]methyl]coumarilohydrazide Formula: C22H20BrN3O2 MolecularWeight: 438.3171

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=NC2=CC=CC=C2C1=CNNC(=O)C3=CC4=C(O3)C=CC(=C4)Br

Isomeric SMILES

CC[C@H](C)C1=NC2=CC=CC=C2C1=CNNC(=O)C3=CC4=C(O3)C=CC(=C4)Br

InChI

InChI=1S/C22H20BrN3O2/c1-3-13(2)21-17(16-6-4-5-7-18(16)25-21)12-24-26-22(27)20-11-14-10-15(23)8-9-19(14)28-20/h4-13,24H,3H2,1-2H3,(H,26,27)/t13-/m0/s1