4-butoxy-N-(2,4-dimethylpentan-3-yl)-N-(1H-imidazol-5-ylmethyl)benzenesulfonamide

Systemtic Name: 4-butoxy-N-(2,4-dimethylpentan-3-yl)-N-(1H-imidazol-5-ylmethyl)benzenesulfonamide Openeye Name: 4-butoxy-N-(1H-imidazol-5-ylmethyl)-N-(1-isopropyl-2-methyl-propyl)benzenesulfonamide CAS Name: 4-butoxy-N-(2,4-dimethylpentan-3-yl)-N-(1H-imidazol-5-ylmethyl)benzenesulfonamide IUPAC Name: 4-butoxy-N-(2,4-dimethylpentan-3-yl)-N-(1H-imidazol-5-ylmethyl)benzenesulfonamide Traditional Name: 4-butoxy-N-(1H-imidazol-5-ylmethyl)-N-(1-isopropyl-2-methyl-propyl)benzenesulfonamide Formula: C21H33N3O3S MolecularWeight: 407.57002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N(CC2=CN=CN2)C(C(C)C)C(C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N(CC2=CN=CN2)C(C(C)C)C(C)C

InChI

InChI=1S/C21H33N3O3S/c1-6-7-12-27-19-8-10-20(11-9-19)28(25,26)24(14-18-13-22-15-23-18)21(16(2)3)17(4)5/h8-11,13,15-17,21H,6-7,12,14H2,1-5H3,(H,22,23)