N-tert-butyl-4-butyl-2-[4-(imidazol-1-ylmethyl)phenyl]benzenesulfonamide

Systemtic Name: N-tert-butyl-4-butyl-2-[4-(imidazol-1-ylmethyl)phenyl]benzenesulfonamide Openeye Name: N-tert-butyl-4-butyl-2-[4-(imidazol-1-ylmethyl)phenyl]benzenesulfonamide CAS Name: N-tert-butyl-4-butyl-2-[4-(1-imidazolylmethyl)phenyl]benzenesulfonamide IUPAC Name: N-tert-butyl-4-butyl-2-[4-(imidazol-1-ylmethyl)phenyl]benzenesulfonamide Traditional Name: N-tert-butyl-4-butyl-2-[4-(imidazol-1-ylmethyl)phenyl]benzenesulfonamide Formula: C24H31N3O2S MolecularWeight: 425.58684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)S(=O)(=O)NC(C)(C)C)C2=CC=C(C=C2)CN3C=CN=C3

Isomeric SMILES

CCCCC1=CC(=C(C=C1)S(=O)(=O)NC(C)(C)C)C2=CC=C(C=C2)CN3C=CN=C3

InChI

InChI=1S/C24H31N3O2S/c1-5-6-7-19-10-13-23(30(28,29)26-24(2,3)4)22(16-19)21-11-8-20(9-12-21)17-27-15-14-25-18-27/h8-16,18,26H,5-7,17H2,1-4H3