methyl 2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]hexanoate

Systemtic Name: methyl 2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]hexanoate Openeye Name: methyl 2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]hexanoate CAS Name: 2-[[4-[(2-methyl-1-benzimidazolyl)methyl]phenyl]sulfonylamino]hexanoic acid methyl ester IUPAC Name: methyl 2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]hexanoate Traditional Name: 2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]hexanoic acid methyl ester Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)CN2C(=NC3=CC=CC=C32)C

Isomeric SMILES

CCCCC(C(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)CN2C(=NC3=CC=CC=C32)C

InChI

InChI=1S/C22H27N3O4S/c1-4-5-8-20(22(26)29-3)24-30(27,28)18-13-11-17(12-14-18)15-25-16(2)23-19-9-6-7-10-21(19)25/h6-7,9-14,20,24H,4-5,8,15H2,1-3H3