N'-[3-bromanyl-4-(3-methylbutoxy)phenyl]carbonyl-3-chloranyl-1-benzothiophene-2-carbohydrazide

Systemtic Name: N'-[3-bromanyl-4-(3-methylbutoxy)phenyl]carbonyl-3-chloranyl-1-benzothiophene-2-carbohydrazide Openeye Name: N'-(3-bromo-4-isopentyloxy-benzoyl)-3-chloro-benzothiophene-2-carbohydrazide CAS Name: N'-[[3-bromo-4-(3-methylbutoxy)phenyl]-oxomethyl]-3-chloro-1-benzothiophene-2-carbohydrazide IUPAC Name: N'-[3-bromo-4-(3-methylbutoxy)benzoyl]-3-chloro-1-benzothiophene-2-carbohydrazide Traditional Name: N'-(3-bromo-4-isoamoxy-benzoyl)-3-chloro-benzothiophene-2-carbohydrazide Formula: C21H20BrClN2O3S MolecularWeight: 495.8171

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=O)NNC(=O)C2=C(C3=CC=CC=C3S2)Cl)Br

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=O)NNC(=O)C2=C(C3=CC=CC=C3S2)Cl)Br

InChI

InChI=1S/C21H20BrClN2O3S/c1-12(2)9-10-28-16-8-7-13(11-15(16)22)20(26)24-25-21(27)19-18(23)14-5-3-4-6-17(14)29-19/h3-8,11-12H,9-10H2,1-2H3,(H,24,26)(H,25,27)