3-methyl-2-[[4-[(2-methyl-2,3-dihydrobenzimidazol-1-yl)methyl]phenyl]sulfonylamino]pentanoic acid

Systemtic Name: 3-methyl-2-[[4-[(2-methyl-2,3-dihydrobenzimidazol-1-yl)methyl]phenyl]sulfonylamino]pentanoic acid Openeye Name: 3-methyl-2-[[4-[(2-methyl-2,3-dihydrobenzimidazol-1-yl)methyl]phenyl]sulfonylamino]pentanoic acid CAS Name: 3-methyl-2-[[4-[(2-methyl-2,3-dihydrobenzimidazol-1-yl)methyl]phenyl]sulfonylamino]pentanoic acid IUPAC Name: 3-methyl-2-[[4-[(2-methyl-2,3-dihydrobenzimidazol-1-yl)methyl]phenyl]sulfonylamino]pentanoic acid Traditional Name: 3-methyl-2-[[4-[(2-methyl-2,3-dihydrobenzimidazol-1-yl)methyl]phenyl]sulfonylamino]valeric acid Formula: C21H27N3O4S MolecularWeight: 417.52178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)CN2C(NC3=CC=CC=C32)C

Isomeric SMILES

CCC(C)C(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)CN2C(NC3=CC=CC=C32)C

InChI

InChI=1S/C21H27N3O4S/c1-4-14(2)20(21(25)26)23-29(27,28)17-11-9-16(10-12-17)13-24-15(3)22-18-7-5-6-8-19(18)24/h5-12,14-15,20,22-23H,4,13H2,1-3H3,(H,25,26)