methyl 2-[2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[[2-[(5-chloro-2-thienyl)methylsulfanyl]acetyl]amino]-4-methyl-pentanoate CAS Name: 2-[[2-[(5-chloro-2-thiophenyl)methylthio]-1-oxoethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[2-[(5-chlorothiophen-2-yl)methylsulfanyl]acetyl]amino]-4-methylpentanoate Traditional Name: 2-[[2-[(5-chloro-2-thienyl)methylthio]acetyl]amino]-4-methyl-valeric acid methyl ester Formula: C14H20ClNO3S2 MolecularWeight: 349.8965

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20ClNO3S2/c1-9(2)6-11(14(18)19-3)16-13(17)8-20-7-10-4-5-12(15)21-10/h4-5,9,11H,6-8H2,1-3H3,(H,16,17)