(5-morpholin-4-ylsulfonyl-1-propyl-benzimidazol-2-yl)methyl 2-(1,2,3,4-tetrazol-1-yl)ethanoate

Systemtic Name: (5-morpholin-4-ylsulfonyl-1-propyl-benzimidazol-2-yl)methyl 2-(1,2,3,4-tetrazol-1-yl)ethanoate Openeye Name: (5-morpholinosulfonyl-1-propyl-benzimidazol-2-yl)methyl 2-(tetrazol-1-yl)acetate CAS Name: 2-(1-tetrazolyl)acetic acid [5-(4-morpholinylsulfonyl)-1-propyl-2-benzimidazolyl]methyl ester IUPAC Name: (5-morpholin-4-ylsulfonyl-1-propylbenzimidazol-2-yl)methyl 2-(tetrazol-1-yl)acetate Traditional Name: 2-(tetrazol-1-yl)acetic acid (5-morpholinosulfonyl-1-propyl-benzimidazol-2-yl)methyl ester Formula: C18H23N7O5S MolecularWeight: 449.48412

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1COC(=O)CN4C=NN=N4

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1COC(=O)CN4C=NN=N4

InChI

InChI=1S/C18H23N7O5S/c1-2-5-25-16-4-3-14(31(27,28)24-6-8-29-9-7-24)10-15(16)20-17(25)12-30-18(26)11-23-13-19-21-22-23/h3-4,10,13H,2,5-9,11-12H2,1H3