2-[2-[[5-ethyl-3-(6-methoxypyridin-3-yl)carbonyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-[[5-ethyl-3-(6-methoxypyridin-3-yl)carbonyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]sulfanylethanoic acid Openeye Name: 2-[2-[[5-ethyl-3-(6-methoxypyridine-3-carbonyl)-2-thienyl]amino]-2-oxo-ethyl]sulfanylacetic acid CAS Name: 2-[[2-[[5-ethyl-3-[(6-methoxy-3-pyridinyl)-oxomethyl]-2-thiophenyl]amino]-2-oxoethyl]thio]acetic acid IUPAC Name: 2-[2-[[5-ethyl-3-(6-methoxypyridine-3-carbonyl)thiophen-2-yl]amino]-2-oxoethyl]sulfanylacetic acid Traditional Name: 2-[[2-[[5-ethyl-3-(6-methoxynicotinoyl)-2-thienyl]amino]-2-keto-ethyl]thio]acetic acid Formula: C17H18N2O5S2 MolecularWeight: 394.46522

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CSCC(=O)O)C(=O)C2=CN=C(C=C2)OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CSCC(=O)O)C(=O)C2=CN=C(C=C2)OC

InChI

InChI=1S/C17H18N2O5S2/c1-3-11-6-12(16(23)10-4-5-14(24-2)18-7-10)17(26-11)19-13(20)8-25-9-15(21)22/h4-7H,3,8-9H2,1-2H3,(H,19,20)(H,21,22)