cyanomethyl 3-(1-methyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)propanoate

Systemtic Name: cyanomethyl 3-(1-methyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)propanoate Openeye Name: cyanomethyl 3-(1-methyl-5-morpholinosulfonyl-benzimidazol-2-yl)propanoate CAS Name: 3-[1-methyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]propanoic acid cyanomethyl ester IUPAC Name: cyanomethyl 3-(1-methyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)propanoate Traditional Name: 3-(1-methyl-5-morpholinosulfonyl-benzimidazol-2-yl)propionic acid cyanomethyl ester Formula: C17H20N4O5S MolecularWeight: 392.4295

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CCC(=O)OCC#N

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CCC(=O)OCC#N

InChI

InChI=1S/C17H20N4O5S/c1-20-15-3-2-13(27(23,24)21-7-10-25-11-8-21)12-14(15)19-16(20)4-5-17(22)26-9-6-18/h2-3,12H,4-5,7-11H2,1H3