N-methyl-N-[1-(oxan-4-ylmethyl)-2-propyl-benzimidazol-5-yl]benzenesulfonamide

Systemtic Name: N-methyl-N-[1-(oxan-4-ylmethyl)-2-propyl-benzimidazol-5-yl]benzenesulfonamide Openeye Name: N-methyl-N-[2-propyl-1-(tetrahydropyran-4-ylmethyl)benzimidazol-5-yl]benzenesulfonamide CAS Name: N-methyl-N-[1-(4-oxanylmethyl)-2-propyl-5-benzimidazolyl]benzenesulfonamide IUPAC Name: N-methyl-N-[1-(oxan-4-ylmethyl)-2-propylbenzimidazol-5-yl]benzenesulfonamide Traditional Name: N-methyl-N-[2-propyl-1-(tetrahydropyran-4-ylmethyl)benzimidazol-5-yl]benzenesulfonamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(N1CC3CCOCC3)C=CC(=C2)N(C)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCCC1=NC2=C(N1CC3CCOCC3)C=CC(=C2)N(C)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H29N3O3S/c1-3-7-23-24-21-16-19(25(2)30(27,28)20-8-5-4-6-9-20)10-11-22(21)26(23)17-18-12-14-29-15-13-18/h4-6,8-11,16,18H,3,7,12-15,17H2,1-2H3