methyl 2-[2-(4-chlorophenyl)sulfanylethanoylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[2-(4-chlorophenyl)sulfanylethanoylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[[2-(4-chlorophenyl)sulfanylacetyl]amino]-4-methyl-pentanoate CAS Name: 2-[[2-[(4-chlorophenyl)thio]-1-oxoethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[2-(4-chlorophenyl)sulfanylacetyl]amino]-4-methylpentanoate Traditional Name: 2-[[2-[(4-chlorophenyl)thio]acetyl]amino]-4-methyl-valeric acid methyl ester Formula: C15H20ClNO3S MolecularWeight: 329.8422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20ClNO3S/c1-10(2)8-13(15(19)20-3)17-14(18)9-21-12-6-4-11(16)5-7-12/h4-7,10,13H,8-9H2,1-3H3,(H,17,18)