(5-morpholin-4-ylsulfonyl-1-propyl-benzimidazol-2-yl)methyl 3-(3,5-dimethylpyrazol-1-yl)propanoate

Systemtic Name: (5-morpholin-4-ylsulfonyl-1-propyl-benzimidazol-2-yl)methyl 3-(3,5-dimethylpyrazol-1-yl)propanoate Openeye Name: (5-morpholinosulfonyl-1-propyl-benzimidazol-2-yl)methyl 3-(3,5-dimethylpyrazol-1-yl)propanoate CAS Name: 3-(3,5-dimethyl-1-pyrazolyl)propanoic acid [5-(4-morpholinylsulfonyl)-1-propyl-2-benzimidazolyl]methyl ester IUPAC Name: (5-morpholin-4-ylsulfonyl-1-propylbenzimidazol-2-yl)methyl 3-(3,5-dimethylpyrazol-1-yl)propanoate Traditional Name: 3-(3,5-dimethylpyrazol-1-yl)propionic acid (5-morpholinosulfonyl-1-propyl-benzimidazol-2-yl)methyl ester Formula: C23H31N5O5S MolecularWeight: 489.58774

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1COC(=O)CCN4C(=CC(=N4)C)C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1COC(=O)CCN4C(=CC(=N4)C)C

InChI

InChI=1S/C23H31N5O5S/c1-4-8-27-21-6-5-19(34(30,31)26-10-12-32-13-11-26)15-20(21)24-22(27)16-33-23(29)7-9-28-18(3)14-17(2)25-28/h5-6,14-15H,4,7-13,16H2,1-3H3