N'-[2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)ethanoyl]-3-chloranyl-1-benzothiophene-2-carbohydrazide

Systemtic Name: N'-[2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)ethanoyl]-3-chloranyl-1-benzothiophene-2-carbohydrazide Openeye Name: N'-[2-(4-bromo-2-isopropyl-5-methyl-phenoxy)acetyl]-3-chloro-benzothiophene-2-carbohydrazide CAS Name: N'-[2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)-1-oxoethyl]-3-chloro-1-benzothiophene-2-carbohydrazide IUPAC Name: N'-[2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)acetyl]-3-chloro-1-benzothiophene-2-carbohydrazide Traditional Name: N'-[2-(4-bromo-2-isopropyl-5-methyl-phenoxy)acetyl]-3-chloro-benzothiophene-2-carbohydrazide Formula: C21H20BrClN2O3S MolecularWeight: 495.8171

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C(C)C)OCC(=O)NNC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CC1=CC(=C(C=C1Br)C(C)C)OCC(=O)NNC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C21H20BrClN2O3S/c1-11(2)14-9-15(22)12(3)8-16(14)28-10-18(26)24-25-21(27)20-19(23)13-6-4-5-7-17(13)29-20/h4-9,11H,10H2,1-3H3,(H,24,26)(H,25,27)