2-[2-[[5-(4-chlorophenyl)-2-methoxycarbonyl-thiophen-3-yl]amino]-2-oxidanylidene-ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-[[5-(4-chlorophenyl)-2-methoxycarbonyl-thiophen-3-yl]amino]-2-oxidanylidene-ethyl]sulfanylethanoic acid Openeye Name: 2-[2-[[5-(4-chlorophenyl)-2-methoxycarbonyl-3-thienyl]amino]-2-oxo-ethyl]sulfanylacetic acid CAS Name: 2-[[2-[[5-(4-chlorophenyl)-2-methoxycarbonyl-3-thiophenyl]amino]-2-oxoethyl]thio]acetic acid IUPAC Name: 2-[2-[[5-(4-chlorophenyl)-2-methoxycarbonylthiophen-3-yl]amino]-2-oxoethyl]sulfanylacetic acid Traditional Name: 2-[[2-[[2-carbomethoxy-5-(4-chlorophenyl)-3-thienyl]amino]-2-keto-ethyl]thio]acetic acid Formula: C16H14ClNO5S2 MolecularWeight: 399.86906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(S1)C2=CC=C(C=C2)Cl)NC(=O)CSCC(=O)O

Isomeric SMILES

COC(=O)C1=C(C=C(S1)C2=CC=C(C=C2)Cl)NC(=O)CSCC(=O)O

InChI

InChI=1S/C16H14ClNO5S2/c1-23-16(22)15-11(18-13(19)7-24-8-14(20)21)6-12(25-15)9-2-4-10(17)5-3-9/h2-6H,7-8H2,1H3,(H,18,19)(H,20,21)