5-bromanyl-2-chloranyl-4-(cyanomethyl)-3,6-bis(2-methylpropyl)benzenesulfonamide

Systemtic Name: 5-bromanyl-2-chloranyl-4-(cyanomethyl)-3,6-bis(2-methylpropyl)benzenesulfonamide Openeye Name: 5-bromo-2-chloro-4-(cyanomethyl)-3,6-diisobutyl-benzenesulfonamide CAS Name: 5-bromo-2-chloro-4-(cyanomethyl)-3,6-bis(2-methylpropyl)benzenesulfonamide IUPAC Name: 5-bromo-2-chloro-4-(cyanomethyl)-3,6-bis(2-methylpropyl)benzenesulfonamide Traditional Name: 5-bromo-2-chloro-4-(cyanomethyl)-3,6-diisobutyl-benzenesulfonamide Formula: C16H22BrClN2O2S MolecularWeight: 421.78008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C(=C(C(=C1Cl)S(=O)(=O)N)CC(C)C)Br)CC#N

Isomeric SMILES

CC(C)CC1=C(C(=C(C(=C1Cl)S(=O)(=O)N)CC(C)C)Br)CC#N

InChI

InChI=1S/C16H22BrClN2O2S/c1-9(2)7-12-11(5-6-19)14(17)13(8-10(3)4)16(15(12)18)23(20,21)22/h9-10H,5,7-8H2,1-4H3,(H2,20,21,22)