methyl 7-[4-[methyl(thiophen-2-ylsulfonyl)amino]butanoylamino]heptanoate

Systemtic Name: methyl 7-[4-[methyl(thiophen-2-ylsulfonyl)amino]butanoylamino]heptanoate Openeye Name: methyl 7-[4-[methyl(2-thienylsulfonyl)amino]butanoylamino]heptanoate CAS Name: 7-[[4-[methyl(thiophen-2-ylsulfonyl)amino]-1-oxobutyl]amino]heptanoic acid methyl ester IUPAC Name: methyl 7-[4-[methyl(thiophen-2-ylsulfonyl)amino]butanoylamino]heptanoate Traditional Name: 7-[4-[methyl(2-thienylsulfonyl)amino]butanoylamino]enanthic acid methyl ester Formula: C17H28N2O5S2 MolecularWeight: 404.54462

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)NCCCCCCC(=O)OC)S(=O)(=O)C1=CC=CS1

Isomeric SMILES

CN(CCCC(=O)NCCCCCCC(=O)OC)S(=O)(=O)C1=CC=CS1

InChI

InChI=1S/C17H28N2O5S2/c1-19(26(22,23)17-11-8-14-25-17)13-7-9-15(20)18-12-6-4-3-5-10-16(21)24-2/h8,11,14H,3-7,9-10,12-13H2,1-2H3,(H,18,20)