methyl 2-methyl-2-[3-(1-methyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)propanoylamino]propanoate

Systemtic Name: methyl 2-methyl-2-[3-(1-methyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)propanoylamino]propanoate Openeye Name: methyl 2-methyl-2-[3-(1-methyl-5-morpholinosulfonyl-benzimidazol-2-yl)propanoylamino]propanoate CAS Name: 2-methyl-2-[[3-[1-methyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]-1-oxopropyl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-methyl-2-[3-(1-methyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)propanoylamino]propanoate Traditional Name: 2-methyl-2-[3-(1-methyl-5-morpholinosulfonyl-benzimidazol-2-yl)propanoylamino]propionic acid methyl ester Formula: C20H28N4O6S MolecularWeight: 452.52452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OC)NC(=O)CCC1=NC2=C(N1C)C=CC(=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(C)(C(=O)OC)NC(=O)CCC1=NC2=C(N1C)C=CC(=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H28N4O6S/c1-20(2,19(26)29-4)22-18(25)8-7-17-21-15-13-14(5-6-16(15)23(17)3)31(27,28)24-9-11-30-12-10-24/h5-6,13H,7-12H2,1-4H3,(H,22,25)