methyl 2-[2-[2,5-bis(chloranyl)phenyl]sulfanylethanoylamino]-3-methyl-butanoate

Systemtic Name: methyl 2-[2-[2,5-bis(chloranyl)phenyl]sulfanylethanoylamino]-3-methyl-butanoate Openeye Name: methyl 2-[[2-(2,5-dichlorophenyl)sulfanylacetyl]amino]-3-methyl-butanoate CAS Name: 2-[[2-[(2,5-dichlorophenyl)thio]-1-oxoethyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[[2-(2,5-dichlorophenyl)sulfanylacetyl]amino]-3-methylbutanoate Traditional Name: 2-[[2-[(2,5-dichlorophenyl)thio]acetyl]amino]-3-methyl-butyric acid methyl ester Formula: C14H17Cl2NO3S MolecularWeight: 350.26068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)CSC1=C(C=CC(=C1)Cl)Cl

Isomeric SMILES

CC(C)C(C(=O)OC)NC(=O)CSC1=C(C=CC(=C1)Cl)Cl

InChI

InChI=1S/C14H17Cl2NO3S/c1-8(2)13(14(19)20-3)17-12(18)7-21-11-6-9(15)4-5-10(11)16/h4-6,8,13H,7H2,1-3H3,(H,17,18)