methyl 4-[2-(2-methylsulfonylbenzimidazol-1-yl)ethanoylamino]butanoate

Systemtic Name: methyl 4-[2-(2-methylsulfonylbenzimidazol-1-yl)ethanoylamino]butanoate Openeye Name: methyl 4-[[2-(2-methylsulfonylbenzimidazol-1-yl)acetyl]amino]butanoate CAS Name: 4-[[2-(2-methylsulfonyl-1-benzimidazolyl)-1-oxoethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-(2-methylsulfonylbenzimidazol-1-yl)acetyl]amino]butanoate Traditional Name: 4-[[2-(2-mesylbenzimidazol-1-yl)acetyl]amino]butyric acid methyl ester Formula: C15H19N3O5S MolecularWeight: 353.39346

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)CN1C2=CC=CC=C2N=C1S(=O)(=O)C

Isomeric SMILES

COC(=O)CCCNC(=O)CN1C2=CC=CC=C2N=C1S(=O)(=O)C

InChI

InChI=1S/C15H19N3O5S/c1-23-14(20)8-5-9-16-13(19)10-18-12-7-4-3-6-11(12)17-15(18)24(2,21)22/h3-4,6-7H,5,8-10H2,1-2H3,(H,16,19)