N'-[2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanylethanoyl]-4-(diethylamino)benzohydrazide

Systemtic Name: N'-[2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanylethanoyl]-4-(diethylamino)benzohydrazide Openeye Name: N'-[2-(4-bromo-2,5-dimethyl-phenyl)sulfanylacetyl]-4-(diethylamino)benzohydrazide CAS Name: N'-[2-[(4-bromo-2,5-dimethylphenyl)thio]-1-oxoethyl]-4-(diethylamino)benzohydrazide IUPAC Name: N'-[2-(4-bromo-2,5-dimethylphenyl)sulfanylacetyl]-4-(diethylamino)benzohydrazide Traditional Name: N'-[2-[(4-bromo-2,5-dimethyl-phenyl)thio]acetyl]-4-(diethylamino)benzohydrazide Formula: C21H26BrN3O2S MolecularWeight: 464.41904

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C(=O)NNC(=O)CSC2=C(C=C(C(=C2)C)Br)C

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C(=O)NNC(=O)CSC2=C(C=C(C(=C2)C)Br)C

InChI

InChI=1S/C21H26BrN3O2S/c1-5-25(6-2)17-9-7-16(8-10-17)21(27)24-23-20(26)13-28-19-12-14(3)18(22)11-15(19)4/h7-12H,5-6,13H2,1-4H3,(H,23,26)(H,24,27)