(5-methyl-1,3,4-oxadiazol-2-yl)methyl 3-(1-propyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)propanoate

Systemtic Name: (5-methyl-1,3,4-oxadiazol-2-yl)methyl 3-(1-propyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)propanoate Openeye Name: (5-methyl-1,3,4-oxadiazol-2-yl)methyl 3-(1-propyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)propanoate CAS Name: 3-[1-propyl-5-(1-pyrrolidinylsulfonyl)-2-benzimidazolyl]propanoic acid (5-methyl-1,3,4-oxadiazol-2-yl)methyl ester IUPAC Name: (5-methyl-1,3,4-oxadiazol-2-yl)methyl 3-(1-propyl-5-pyrrolidin-1-ylsulfonylbenzimidazol-2-yl)propanoate Traditional Name: 3-(1-propyl-5-pyrrolidinosulfonyl-benzimidazol-2-yl)propionic acid (5-methyl-1,3,4-oxadiazol-2-yl)methyl ester Formula: C21H27N5O5S MolecularWeight: 461.53458

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)N=C1CCC(=O)OCC4=NN=C(O4)C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)N=C1CCC(=O)OCC4=NN=C(O4)C

InChI

InChI=1S/C21H27N5O5S/c1-3-10-26-18-7-6-16(32(28,29)25-11-4-5-12-25)13-17(18)22-19(26)8-9-21(27)30-14-20-24-23-15(2)31-20/h6-7,13H,3-5,8-12,14H2,1-2H3