methyl 4-[2-[(5-chloranylthiophen-2-yl)sulfonyl-methyl-amino]ethanoylamino]butanoate

Systemtic Name: methyl 4-[2-[(5-chloranylthiophen-2-yl)sulfonyl-methyl-amino]ethanoylamino]butanoate Openeye Name: methyl 4-[[2-[(5-chloro-2-thienyl)sulfonyl-methyl-amino]acetyl]amino]butanoate CAS Name: 4-[[2-[(5-chloro-2-thiophenyl)sulfonyl-methylamino]-1-oxoethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-[(5-chlorothiophen-2-yl)sulfonyl-methylamino]acetyl]amino]butanoate Traditional Name: 4-[[2-[(5-chloro-2-thienyl)sulfonyl-methyl-amino]acetyl]amino]butyric acid methyl ester Formula: C12H17ClN2O5S2 MolecularWeight: 368.85678

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NCCCC(=O)OC)S(=O)(=O)C1=CC=C(S1)Cl

Isomeric SMILES

CN(CC(=O)NCCCC(=O)OC)S(=O)(=O)C1=CC=C(S1)Cl

InChI

InChI=1S/C12H17ClN2O5S2/c1-15(22(18,19)12-6-5-9(13)21-12)8-10(16)14-7-3-4-11(17)20-2/h5-6H,3-4,7-8H2,1-2H3,(H,14,16)