methyl 2-[2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoylamino]-2-methyl-pentanoate

Systemtic Name: methyl 2-[2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoylamino]-2-methyl-pentanoate Openeye Name: methyl 2-[[2-[(5-chloro-2-thienyl)methylsulfanyl]acetyl]amino]-2-methyl-pentanoate CAS Name: 2-[[2-[(5-chloro-2-thiophenyl)methylthio]-1-oxoethyl]amino]-2-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[2-[(5-chlorothiophen-2-yl)methylsulfanyl]acetyl]amino]-2-methylpentanoate Traditional Name: 2-[[2-[(5-chloro-2-thienyl)methylthio]acetyl]amino]-2-methyl-valeric acid methyl ester Formula: C14H20ClNO3S2 MolecularWeight: 349.8965

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(=O)OC)NC(=O)CSCC1=CC=C(S1)Cl

Isomeric SMILES

CCCC(C)(C(=O)OC)NC(=O)CSCC1=CC=C(S1)Cl

InChI

InChI=1S/C14H20ClNO3S2/c1-4-7-14(2,13(18)19-3)16-12(17)9-20-8-10-5-6-11(15)21-10/h5-6H,4,7-9H2,1-3H3,(H,16,17)