3-[(2-chloranyl-4-hexyl-phenyl)methyl]-2-methyl-N-[(E)-pent-1-enyl]sulfonyl-benzimidazole-5-carboxamide

Systemtic Name: 3-[(2-chloranyl-4-hexyl-phenyl)methyl]-2-methyl-N-[(E)-pent-1-enyl]sulfonyl-benzimidazole-5-carboxamide Openeye Name: 3-[(2-chloro-4-hexyl-phenyl)methyl]-2-methyl-N-[(E)-pent-1-enyl]sulfonyl-benzimidazole-5-carboxamide CAS Name: 3-[(2-chloro-4-hexylphenyl)methyl]-2-methyl-N-[(E)-pent-1-enyl]sulfonyl-5-benzimidazolecarboxamide IUPAC Name: 3-[(2-chloro-4-hexylphenyl)methyl]-2-methyl-N-[(E)-pent-1-enyl]sulfonylbenzimidazole-5-carboxamide Traditional Name: 3-(2-chloro-4-hexyl-benzyl)-2-methyl-N-[(E)-pent-1-enyl]sulfonyl-benzimidazole-5-carboxamide Formula: C27H34ClN3O3S MolecularWeight: 516.09516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=C(C=C1)CN2C(=NC3=C2C=C(C=C3)C(=O)NS(=O)(=O)C=CCCC)C)Cl

Isomeric SMILES

CCCCCCC1=CC(=C(C=C1)CN2C(=NC3=C2C=C(C=C3)C(=O)NS(=O)(=O)/C=C/CCC)C)Cl

InChI

InChI=1S/C27H34ClN3O3S/c1-4-6-8-9-11-21-12-13-23(24(28)17-21)19-31-20(3)29-25-15-14-22(18-26(25)31)27(32)30-35(33,34)16-10-7-5-2/h10,12-18H,4-9,11,19H2,1-3H3,(H,30,32)/b16-10+